[
{
"instruction": "Predict a possible product from the listed reactants and reagents. CCN.CN1C=CC=C1C=O ",
"input": "",
"output": " CCNCC1=CC=CN1C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CN(C)C=CC(=O)C1=CC=CO1.CS(C)=O.Cl.N#CCC(N)=O.O.O=C([O-])[O-].[K+] ",
"input": "",
"output": " N#CC1=CC=C(C2=CC=CO2)NC1=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CCN(CC)CC.CS(=O)(=O)Cl.ClCCl.OCC1=COC(Cl)=N1.[Cl-].[NH4+] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CS(=O)(=O)OCC1=COC(Cl)=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CC=NC=C1.CN(C)C1=CC=CC(C(=O)Cl)=C1.NC1=NNC2=CC=C([N+](=O)[O-])C=C12 Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CN(C)C1=CC=CC(C(=O)NC2=NNC3=CC=C([N+](=O)[O-])C=C23)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CC1COC2=C3C(=CC(F)=C2C2=CSC(CN)=N2)C(=O)C(C(=O)O)=CN31.CCNCC1=NC(C2=C(F)C=C3C(=O)C(C(=O)O)=CN(CCF)C3=C2F)=CS1 as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CNCC1=NC(C2=C(F)C=C3C(=O)C(C(=O)O)=CN(CCF)C3=C2F)=CS1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C1=CC=C([PH](C2=CC=CC=C2)(C2=CC=CC=C2)[Pd]([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)[PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.CC(C)(C)OC(=O)N[C@H]1COCC[C@H]1NC1=NC(Cl)=C2C(=O)N(C(=O)OC(C)(C)C)CC2=C1F.CC1=CC=CC=C1.CCCC[Sn](CCCC)(CCCC)C1=CC2=CN=CC=C2S1 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC(C)(C)OC(=O)N[C@H]1CCCC[C@H]1NC1=NC(C2=CC3=CN=CC=C3S2)=C2C(=O)N(C(=O)OC(C)(C)C)CC2=C1F ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " NC1=CC=C2C(=C1)C[C@@H]1NCCC[C@H]21.O=C(O)C1=CC=C2NC=NC2=C1 Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be NC1=CC=C2C(=C1)C[C@H]1[C@@H]2CCCN1C(=O)C1=CC=C2NC=NC2=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with COC1=CC(C(=O)O)=CC=C1C1=CC=CC=N1.C[Si](C)(C)OP(=O)=O.NC1=CN=CC=C1O as the reactants and reagents.",
"input": "",
"output": " COC1=CC(C2=NC3=CN=CC=C3O2)=CC=C1C1=CC=CC=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1COCCO1.C[C@H](O)CN.O=S(=O)(NC1=CC=CC(C2=C(C3=CC=NC(Cl)=N3)SC(C3CCOCC3)=N2)=C1F)C1=COC=C1 ",
"input": "",
"output": " C[C@H](O)CNC1=NC=CC(C2=C(C3=CC=CC(NS(=O)(=O)C4=COC=C4)=C3F)N=C(C3CCOCC3)S2)=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCN(C(C)C)C(C)C.CCN=C=NCCCN(C)C.CN(C)C=O.CNC(=O)C1=CC=C(N)C=C1.COC1=CC=C(NC2=CC(C3=CC=CC(C(=O)O)=C3)=NN3C=CN=C23)N=C1OC.ON1N=NC2=CC=CC=C21 Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CNC(=O)C1=CC=C(NC(=O)C2=CC=CC(C3=NN4C=CN=C4C(NC4=CC=C(OC)C(OC)=N4)=C3)=C2)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC(=O)[O-].CC1=CC(C2=CC=CC=C2)=CC(C)=C1[Pb+3].CC1=CC=CC=C1.CN(C)C1=CC=NC=C1.Cl.ClC(Cl)Cl.O=C1CC(=O)CC2(CCOCC2)C1 ",
"input": "",
"output": " CC1=CC(C2=CC=CC=C2)=CC(C)=C1C1C(=O)CC2(CCOCC2)CC1=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC(=O)O.CO.Cl.O=C1NC2=CC(C3=CC=CO3)=CC=C2C2=C1CCC2.[MgH2] .",
"input": "",
"output": " O=C1NC2=CC(C3=CC=CO3)=CC=C2C2CCCC12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. N#CSCCl.OC(=S)C1=CC=CC=C1Cl ",
"input": "",
"output": " N#CSCOC(=S)C1=CC=CC=C1Cl ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC(=O)[O-].CC(C)NCC(=O)N1CC(C)(C)C2=CC=C(N3C(=O)N(CC4=CC=NC(Cl)=C4)C(C)(C)C3=O)C=C21.CC1(C)C2=CC=C(P(C3=CC=CC=C3)C3=CC=CC=C3)C=C2OC2=CC(P(C3=CC=CC=C3)C3=CC=CC=C3)=CC=C21.CN1CCCC1=O.ClCCl.NC1=CC=CN=C1.O=C([O-])[O-].[Cs+].[Pd+2] as the reactants and reagents.",
"input": "",
"output": " CC(C)NCC(=O)N1CC(C)(C)C2=CC=C(N3C(=O)N(CC4=CC=NC(NC5=CC=CN=C5)=C4)C(C)(C)C3=O)C=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C1CCOC1.CC(C)(C)C1=CC(N)=NO1.NC1=NNC=C1.O=C1NC2=CC=CC=C2/C1=C/O , what product could potentially be produced?",
"input": "",
"output": "The product can be CC(C)(C)C1=CC(NC=C2C(=O)NC3=CC=CC=C23)=NO1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " Br.CCOC(=O)C1=C(C2=CC(OC)=C(OC)C([N+](=O)[O-])=C2)OC=N1 Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be NCC(=O)C1=CC(O)=C(O)C([N+](=O)[O-])=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C1CCOC1.CCOC(=O)C1=C(C2=CC=CC=C2)C2=CC=C(OC)C=C2C1=O.Cl[Mg]C1CCCCC1 .",
"input": "",
"output": " CCOC(=O)C1=C(C2=CC=CC=C2)C2=CC=C(OC)C=C2C1(O)C1CCCCC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CCCCC1=CC=C(CNCC2=CC=CC(CC(=O)OC)=C2)C=C1.CN1C=NC(S(=O)(=O)Cl)=C1 ",
"input": "",
"output": " CCCCC1=CC=C(CN(CC2=CC=CC(CC(=O)OC)=C2)S(=O)(=O)C2=CN(C)C=N2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CC=C(CN2C(NC3CCNC3)=NC3=CC=CC=C32)N=C1.CN(C)C=O.Cl.N#CCCl.O=C([O-])[O-].[Na+] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " N#CCN1CCC(NC2=NC3=CC=CC=C3N2CC2=CC=CC=N2)C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC1=CC=CC=C1.CCO.CCOC(=O)N1CCN(CCC2=CC=CC(Cl)=C2)CC1.CCOC(=O)N1CCNCC1.ClC1=CC=CC(CCBr)=C1.O.[K+].[OH-] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " ClC1=CC=CC(CCN2CCNCC2)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC[Si](CC)(CC)O[C@@H]1C[C@H](O)[C@H](C/C=C\\CCCC23OCC(C)(CO2)CO3)[C@H]1CS(=O)(=O)C1=CC=CC=C1.O=P(C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1 ",
"input": "",
"output": " CC12COC(CCC/C=C\\C[C@@H]3[C@@H](CS(=O)(=O)C4=CC=CC=C4)[C@H](O)C[C@@H]3O)(OC1)OC2 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. C1COCCO1.CC1(C)C2=CC=CC(P(C3=CC=CC=C3)C3=CC=CC=C3)=C2OC2=C(P(C3=CC=CC=C3)C3=CC=CC=C3)C=CC=C21.CC1=C(Br)C=CC2=C(Cl)C=CN=C12.CCN(C(C)C)C(C)C.O=C(/C=C/C1=CC=CC=C1)/C=C/C1=CC=CC=C1.SCC1=CC=CC=C1.[Pd] ",
"input": "",
"output": " CC1=C(SCC2=CC=CC=C2)C=CC2=C(Cl)C=CN=C12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC1=C(Br)C(=O)N(C2CCCC2)C2=NC(S(C)=O)=NC=C12.CC1=CC=CC=C1.CN1CCN(C2=CC=C(N)N=C2)CC1 Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CC1=C(Br)C(=O)N(C2CCCC2)C2=NC(NC3=CC=C(N4CCN(C)CC4)C=N3)=NC=C12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CN(C)C=O.ClCCCBr.N#CC1=CC=C(C2=CC=CC=C2)C(O)=C1.O=C([O-])[O-].[K+] ",
"input": "",
"output": " N#CC1=CC=C(C2=CC=CC=C2)C(OCCCCl)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C1CCOC1.CCOC(=O)CCCCC(=O)C1=C(C)C=C(C)C(C)=C1O.[Al+3].[H-].[Li+] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC1=CC(C)=C(C(O)CCCCCO)C(O)=C1C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C1=CN=C(N2CCNCC2)N=C1.COC1=CC=C(CN(CC2=CC=C(OC)C=C2)C2=NC=C(C3=NC(N4CCOCC4)=NC4=C3CCN4C3=CC=C(C(=O)O)C=C3)C=N2)C=C1.Cl as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " COC1=CC=C(CN(CC2=CC=C(OC)C=C2)C2=NC=C(C3=NC(N4CCOCC4)=NC4=C3CCN4C3=CC=C(C(=O)N4CCN(C5=NC=CC=N5)CC4)C=C3)C=N2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(=O)O.COC1=CC=C(CNC2=NC=NC3=C2C=CN3[C@@H]2O[C@H](CN(CCCCC(=O)NC3=CC=C(C(C)(C)C)C=C3N)C(C)C)[C@H]3OC(C)(C)O[C@H]32)C(OC)=C1 Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be COC1=CC=C(CNC2=NC=NC3=C2C=CN3[C@@H]2O[C@H](CN(CCCCC3=NC4=CC(C(C)(C)C)=CC=C4N3)C(C)C)[C@H]3OC(C)(C)O[C@H]32)C(OC)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1CCOC1.CCN(CC)S(F)(F)F.CCOC(=O)C1=CN2C3=C(CCN2CO)C(F)=C(F)C=C3C1=O.CO ",
"input": "",
"output": " CCOC(=O)C1=CN2C3=C(CCN2COC)C(F)=C(F)C=C3C1=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C1=CC=C(P(C2=CC=CC=C2)[C-]2C=CC=C2)C=C1.C=C(OC)O[Si](C)(C)C(C)(C)C.CC(=O)[O-].CC1=NC2=CC(Cl)=CC(OS(=O)(=O)C(F)(F)F)=C2C(C)=C1CC1=CC=C(Cl)C=C1.CC1=NC2=CC(OS(=O)(=O)C(F)(F)F)=CC(Cl)=C2C(C)=C1CC1=CC=C(Cl)C=C1.CCOC(C)=O.CN(C)C=O.O=C(C=CC1=CC=CC=C1)C=CC1=CC=CC=C1.[Fe+2].[Na+].[Pd] .",
"input": "",
"output": " COC(=O)CC1=CC(Cl)=CC2=NC(C)=C(CC3=CC=C(Cl)C=C3)C(C)=C12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC(=O)[O-].CC1=CC=C(Cl)C=C1C1CC(=O)CC(=O)C1.CCO.[NH4+] .",
"input": "",
"output": " CC1=CC=C(Cl)C=C1C1CC(=O)C=C(N)C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CCC(=O)[O-].CCO.FC(F)(F)C1=CN=C2C(=C1)C=CN2CC1=CC=NC=C1.O.[K+].[OH-] .",
"input": "",
"output": " O=C(O)C1=CC2=CC(C(F)(F)F)=CN=C2N1CC1=CC=NC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC(C)[N-]C(C)C.CI.CN(C)C=O.N#CC1=CC=C(C2NC(=O)N(C3=CC=CC(C(F)(F)F)=C3)C3=C2C(=O)CCC3)C=C1.O.[Li+] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CN1C(=O)N(C2=CC=CC(C(F)(F)F)=C2)C2=C(C(=O)CCC2)C1C1=CC=C(C#N)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if BrBr.CC(=O)O.O=CC1=CC(=O)C(OCC2=CC=CC=C2)=CN1 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " O=CC1=C(Br)C(=O)C(OCC2=CC=CC=C2)=CN1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)(C)C1=CC(F)=C2C(=O)N(C3=CC=CC(N4C=C(C#N)C=N4)=C3)N=CC2=C1.CCO.O Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CC(C)(C)C1=CC(F)=C2C(=O)N(C3=CC=CC(N4C=C(C(N)=O)C=N4)=C3)N=CC2=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CC=NC=C1.C1CCOC1.CC1=CC(N)=CC(N2CCC3=CC=CC=C3C2)=N1.CCOC(=O)C(=O)Cl Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CCOC(=O)C(=O)NC1=CC(C)=NC(N2CCC3=CC=CC=C3C2)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC(C)(C)OC(=O)N1CCC(C2=CC=C(OCCCOCC3=CC=CC=C3)C=C2)C(OCC2=CC=C3C=CC(CBr)=CC3=C2)C1.CN(C)CC1=CC=C2C=CC(COC3CN(C(=O)OC(C)(C)C)CCC3C3=CC=C(OCCCOCC4=CC=CC=C4)C=C3)=CC2=C1.OCCOC1CCCCO1 .",
"input": "",
"output": " OCCOCC1=CC=C2C=CC(COC3CNCCC3C3=CC=C(OCCCOCC4=CC=CC=C4)C=C3)=CC2=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CCOC(=O)N1CCC(Br)C(O[Si](C)(C)C(C)(C)C)C1.CCOC(=O)N1CCC(N=[N+]=[N-])C(O)C1 ",
"input": "",
"output": " CCOC(=O)N1CCC(N=[N+]=[N-])C(O[Si](C)(C)C(C)(C)C)C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C1CC2=C(C1)O2.C1CCOC1.CC(=O)[O-].CC(C)O.CC(C)OP(OC(C)C)OC(C)C.CCCCCC.CN1CCCC1=NC1=NC=NC2=C1NC=N2.CN1CCCC1=O.CS(C)=O.NC1=NC=NC2=C1NC=N2.[Li]CCCC.[Pd+2] , what product could potentially be produced?",
"input": "",
"output": "The product can be CN1CCCC1=NC1=NC=NC2=C1N=CN2C1C=CC(O)C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. BrB(Br)Br.CCOC(=O)NC1COC2=CC=C(OC)C=C2C1CC1=CC=CC=C1.ClCCl.O=C([O-])O.[Na+] ",
"input": "",
"output": " CCOC(=O)NC1COC2=CC=C(O)C=C2C1CC1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1=CC=C([PH](C2=CC=CC=C2)(C2=CC=CC=C2)[Pd]([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)[PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.C1COCCO1.CC1(C)OB(C2=CC=C3C(=O)OCC3=C2)OC1(C)C.COC1=CC=C(Br)C(OC)=C1OCC1CC1.O=C([O-])[O-].[Cs+] as the reactants and reagents.",
"input": "",
"output": " COC1=CC=C(C2=CC=C3C(=O)OCC3=C2)C(OC)=C1OCC1CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1CCOC1.CCN(C(C)C)C(C)C.CN(C)C(ON1C(=O)CCC1=O)=[N+](C)C.F[B-](F)(F)F.O=C(O)CCCOC1=CC=C2NC(=O)OC(C#CC3CC3)(C(F)(F)F)C2=C1 as the reactants and reagents.",
"input": "",
"output": " O=C(CCCOC1=CC=C2NC(=O)OC(C#CC3CC3)(C(F)(F)F)C2=C1)ON1C(=O)CCC1=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CO.ClCCl.O=C(CC1(C2=CC=CC=C2)CCC1)C1=CC=CC=N1.[BH4-].[Na+] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be OC(CC1(C2=CC=CC=C2)CCC1)C1=CC=CC=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CCOC(=O)C1=C(C)N=C(N2C=NNC2=O)S1.FC1(F)CC1CBr.FC1=CC=C(CBr)C=C1 as the reactants and reagents.",
"input": "",
"output": " CCOC(=O)C1=C(C)N=C(N2C=NN(CC3=CC=C(F)C=C3)C2=O)S1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C=CC1=CC=NC=C1.CC(=O)[O-].CC1=CC=CC=C1P(C1=CC=CC=C1C)C1=CC=CC=C1C.CCN(CC)CC.CN(C)C=O.COC1=CC=CC=C1CNC1=CC=C2C=C(Br)C=CC2=N1.O.[Pd+2] .",
"input": "",
"output": " COC1=CC=CC=C1CNC1=CC=C2C=C(/C=C/C3=CC=NC=C3)C=CC2=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C1CCOC1.CO.ClCCl.O=C(C1=CC=C(C2=CC=NC=C2)C=C1)N1CCN(S(=O)(=O)C2=CC3=CC=C(Cl)C=C3N2S(=O)(=O)C2=CC=CC=C2)CC1.O=C([O-])O.[Cl-].[K+].[NH4+].[Na+].[OH-] , what product could potentially be produced?",
"input": "",
"output": "The product can be O=C(C1=CC=C(C2=CC=NC=C2)C=C1)N1CCN(S(=O)(=O)C2=CC3=CC=C(Cl)C=C3N2)CC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with BrBr.CC(=O)O.CC(=O)[O-].COC1=CC=C(N)C=N1.[Na+].[OH-] as the reactants and reagents.",
"input": "",
"output": " COC1=CC=C(N)C(Br)=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CN1CCC2=C(N)C=CC=C2C1.COC1=CC=C(C(=O)Cl)C(OC)=C1 Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be COC1=CC=C(C(=O)NC2=CC=CC3=C2CCN(C)C3)C(OC)=C1.Cl .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CCC1=CC=CC(N)=C1.CCOCC.N#CBr is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CCC1=CC=CC(NC#N)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC(C)=O.CCCCCCCCCCCCNC(=N)NC(=N)NCC1=CC=C(S(N)(=O)=O)C=C1.CO.Cl ",
"input": "",
"output": " CCCCCCCCCCCCNC1=NC(C)(C)N=C(NCC2=CC=C(S(N)(=O)=O)C=C2)N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using BrB(Br)Br.COC1=CC=CC2=C1C(CC(N)=O)=CN2CC1=CC=CC=C1 as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " NC(=O)CC1=CN(CC2=CC=CC=C2)C2=CC=CC(O)=C12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CCO.CCOC(=O)C1=NC2=CC=CC=C2S1.NN as the reactants and reagents.",
"input": "",
"output": " NNC(=O)C1=NC2=CC=CC=C2S1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1CCCCC1.CCO.CCOC(=O)CC1NCCC2=C1NC1=CC=C(Cl)C=C21.CN=C=O.Cl ",
"input": "",
"output": " CN1C(=O)CC2C3=C(CCN2C1=O)C1=CC(Cl)=CC=C1N3 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C1CCOC1.CN1C(Cl)=NC=C(Br)C1=O.Cl[Pd](Cl)([PH](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1)[PH](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1.[Br-].[Zn+]CC1CCCCC1 , what product could potentially be produced?",
"input": "",
"output": "The product can be CN1C(CC2CCCCC2)=NC=C(Br)C1=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CCO.CCOC(=O)C(=CC=C(SC)C(=O)C1=CC=C(N(C)C)C=C1)N(C)C.Cl ",
"input": "",
"output": " CCOC(=O)C(O)=CC=C(SC)C(=O)C1=CC=C(N(C)C)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: COC(=O)C1=CC=C(B2OC(C)(C)C(C)(C)O2)C(C(F)(F)F)=C1.OC1=CC=C2N=C(Cl)C=CC2=C1 , what product could potentially be produced?",
"input": "",
"output": "The product can be O=C(O)C1=CC=C(C2=CC=C3C=C(O)C=CC3=N2)C(C(F)(F)F)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCC(C)=O.NC(=O)CI.NC1=NC2=CC=C(OC(F)(F)F)C=C2S1 Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be N=C1SC2=CC(OC(F)(F)F)=CC=C2N1CC(N)=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.CN(C)S(=O)(=O)N1C=C(CC(C)(C)C)N=C1C(=O)CC1=CC=C(N2CCCC3=C2N(COCC[Si](C)(C)C)N=C3)C=C1.C[Mg]Br Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CN(C)S(=O)(=O)N1C=C(CC(C)(C)C)N=C1C(C)(O)CC1=CC=C(N2CCCC3=C2N(COCC[Si](C)(C)C)N=C3)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C1=CC=NC=C1.CC(=O)Cl.CC(C)C1=C2C(=O)NC=NN2C=C1C#N.CCO.CCOC(C)=O.Cl.NO.O.O=C([O-])[O-].[K+] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CC1=NC(C2=CN3N=CN=C(O)C3=C2C(C)C)=NO1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. C1CCOC1.COC1=CC=C(C(=O)C(C)C(C)C(=O)C2=CC=C(OC)C(OC)=C2)C=C1OC.O=S(=O)([O-])[O-].[Al+3].[H-].[Li+].[Na+] ",
"input": "",
"output": " COC1=CC=C(C(O)C(C)C(C)C(O)C2=CC=C(OC)C(OC)=C2)C=C1OC ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C1=CC=[NH+]C=C1.C1CCOC1.CCOCC.NC1=CC=C(N2C=CC=N2)C(F)=C1.[Br-] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: NC1=CC(F)=C(N2C=CC=N2)C=C1Br .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC1=CC(C)=C(C2=C3N=C(C)C4=C(NCC4)N3N=C2C)C(C)=C1.CCCCS(=O)(=O)Cl.CCN(CC)CC.ClCCl.O ",
"input": "",
"output": " CCCCS(=O)(=O)N1CCC2=C1N1N=C(C)C(C3=C(C)C=C(C)C=C3C)=C1N=C2C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CCOC(C)=O.COC1=CC=C(C2=NSC(N)=C2)C=C1F.C[Al](C)C.C[C@@H]1C[C@H]1C(=O)OCC1=CC=CC=C1.Cl.ClCCl.O is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " COC1=CC=C(C2=NSC(NC(=O)[C@@H]3C[C@H]3C)=C2)C=C1F ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC1(C)OC[C@@H](CCCOC2=C(C(C)(C)C)C=C(SC(C)(C)SC3=CC(C(C)(C)C)=C(O)C(C(C)(C)C)=C3)C=C2C(C)(C)C)O1.CO.Cl.[K+].[OH-] ",
"input": "",
"output": " CC(C)(SC1=CC(C(C)(C)C)=C(O)C(C(C)(C)C)=C1)SC1=CC(C(C)(C)C)=C(OCCC[C@H](O)CO)C(C(C)(C)C)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C(=NC1CCCCC1)=NC1CCCCC1.CC#N.CC(=O)OC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)OCC1=CC=CC=C1)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)C(=O)O.CCN(CC)CC.CCOC(=O)C[C@H](N)C1=CC=C(C)C=C1 Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CCOC(=O)C[C@H](NC(=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H](COC(C)=O)NC(=O)[C@H](CC(C)C)NC(=O)OCC1=CC=CC=C1)C1=CC=C(C)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CCOCC.Cl.O=C(C1=CC=CC=C1)N1CCN(CCCC(C2=CC=C(F)C=C2)C2=CC=C(F)C=C2)CCN1C(=O)C1=CC=CC=C1.[Al+3].[H-].[Li+] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: FC1=CC=C(C(CCCN2CCN(CC3=CC=CC=C3)N(CC3=CC=CC=C3)CC2)C2=CC=C(F)C=C2)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)C[Al+]CC(C)C.CCCCCC.COCCOCOC1=CC(Cl)=C(C=CC(=O)[O-])C=C1OCOCCOC.[H-] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " C=CC1=CC(OCOCCOC)=C(OCOCCOC)C=C1Cl ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CI.CN(C)C=O.NC1=CC([N+](=O)[O-])=CC=C1F.O.O=C([O-])[O-].[K+] ",
"input": "",
"output": " CN(C)C1=CC([N+](=O)[O-])=CC=C1F ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCO.NC1=NC(Cl)=CC(Cl)=N1.NCC1=CC=CC=C1.O=C([O-])[O-].[K+] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be NC1=NC(Cl)=CC(NCC2=CC=CC=C2)=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CC(C)(C)OC(=O)NC(COS(C)(=O)=O)C1=CC=C(Cl)C=C1.CN(C)C=O.[C-]#N.[Na+] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CC(C)(C)OC(=O)NC(CC#N)C1=CC=C(Cl)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC(=O)O.CS(C)=O.O.O=[N+]([O-])/C=C/C1=CC=C(OC2=CC=CN=C2)C=C1.[BH4-].[Na+] as the reactants and reagents.",
"input": "",
"output": " O=[N+]([O-])CCC1=CC=C(OC2=CC=CN=C2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CC(C)(C)C1=CC=CC=C1N1CCNCC1.CCN(C(C)C)C(C)C.Cl.ClCCl.O=C(Cl)C1=CC=CC=N1 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CC(C)(C)C1=CC=CC=C1N1CCN(C(=O)C2=CC=CC=N2)CC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(=O)NC1=CC2=C(C=C1C#N)C(NC1=CC=C(C(=O)OC(C)(C)C)C(F)=C1)CC2.CCO.O.OO.[Na+].[OH-] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CC1=NC2=CC3=C(C=C2C(=O)N1)C(NC1=CC=C(C(=O)OC(C)(C)C)C(F)=C1)CC3 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CCN=C=NCCCN(C)C.CN(C)C=O.COCOC1=C(C(=O)O)SC2=CC(OCC3=CC=C(Cl)C=C3Cl)=CC=C12.O ",
"input": "",
"output": " COCOC1=C(C(N)=O)SC2=CC(OCC3=CC=C(Cl)C=C3Cl)=CC=C12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C1CCOC1.CCCCOC1=NC(N)=C2NC(=O)N(CCCCN(CCCN3CCCC3=O)CC3=CC=CC(CC(=O)OC)=C3)C2=N1.O.[Li+].[OH-] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CCCCOC1=NC(N)=C2NC(=O)N(CCCCN(CCCN3CCCC3=O)CC3=CC=CC(CC(=O)O)=C3)C2=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC(C)=O.CC(C)O.O.O=S(=O)(O)O.OCCCOC1=CC(F)=CC(F)=C1.[Cr+6].[O-2] , what product could potentially be produced?",
"input": "",
"output": "The product can be O=C(O)CCOC1=CC(F)=CC(F)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CN1C(CCl)=NC2=CC=CC=C21.COC(O)C(O)OC.COC1=CC=C(CCC2(C3CCCC3)CC(=O)CC(=O)O2)C=C1Cl.O.O=C([O-])[O-].[Na+] , what product could potentially be produced?",
"input": "",
"output": "The product can be COC1=CC=C(CCC2(C3CCCC3)CC(=O)C(CC3=NC4=CC=CC=C4N3C)C(=O)O2)C=C1Cl .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1=CC=CC=C1.CC1=CC=C(S(=O)(=O)O)C=C1.CCC(=O)CC.CCOC(=O)C1=CN(C(CO)CO)C2=CC(NC3CCCCC3)=C(F)C=C2C1=O.O ",
"input": "",
"output": " CCOC(=O)C1=CN(C2COC(CC)(CC)OC2)C2=CC(NC3CCCCC3)=C(F)C=C2C1=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CCO.CCOC(=O)C1=C([N+](=O)[O-])C=CC(C=CN(C)C)=C1[N+](=O)[O-].[Ni] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CCOC(=O)C1=C(N)C=CC2=C1NC=C2 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CCO.CCOC(=O)C1=C([N+](=O)[O-])C=CC(/C=C/N(C)C)=C1[N+](=O)[O-].[Ni] .",
"input": "",
"output": " CCOC(=O)C1=C(N)C=CC2=C1NC=C2 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. C1=NNC=N1.CC#N.CC(C)(COC1=CC=C(Cl)C=C1)C(=O)C(Br)OC1=CC=C(Cl)C=C1.CC(C)=O.O.O=S(=O)(O)C1=CC=CC2=C(S(=O)(=O)O)C=CC=C12 ",
"input": "",
"output": " CC(C)(COC1=CC=C(Cl)C=C1)C(=O)C(OC1=CC=C(Cl)C=C1)N1C=NC=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " NCCN.O=[N+]([O-])C1=CC=C(Cl)C(S(=O)(=O)CCO)=C1 Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be NCCNC1=CC=C([N+](=O)[O-])C=C1S(=O)(=O)CCO .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC1=CC=C2C(Cl)=CC=NC2=N1.COC1=CC=C(SC2=CC=C(C)C=C2N)C=C1OC Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be COC1=CC=C(SC2=CC=C(C)C=C2NC2=CC=NC3=NC(C)=CC=C23)C=C1OC .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CCO.CC[O-].COC1=CC=C(NC(=S)NNC(=O)C2=CC=CS2)C=C1.[Na+] , what product could potentially be produced?",
"input": "",
"output": "The product can be COC1=CC=C(N2C(C3=CC=CS3)=NNC2=S)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CCN(CC)CC.ClCBr.OCC1=CC=C(S)C=C1 , what product could potentially be produced?",
"input": "",
"output": "The product can be OCC1=CC=C(SCCl)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(=O)CC(C)C.CO[C@@H]1CNCC[C@@H]1NC(=O)C1=CC=CC=C1.C[N+](C)=C1OCCC1(C1=CC=CC=C1)C1=CC=CC=C1.O.O=C([O-])[O-].[Br-].[I-].[K+].[Na+] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CO[C@@H]1CN(CCC(C(=O)N(C)C)(C2=CC=CC=C2)C2=CC=CC=C2)CC[C@@H]1NC(=O)C1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CN1N=NC2=C(N)C(N)=CC=C21.Cl.O.O=C(O)C(=O)O ",
"input": "",
"output": " CN1N=NC2=C3N=C(O)C(O)=NC3=CC=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC(=O)NC1=CC=C(OCCCCl)C=C1.CN(C)C=O.N#N.OC1=CC=C(Cl)C(Cl)=C1.[H-].[Na+] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CC(=O)NC1=CC=C(OCCCOC2=CC=C(Cl)C(Cl)=C2)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CCN(CC)CC.CCN=C=NCCCN(C)C.CN(C)C1=CC=NC=C1.CS(N)(=O)=O.C[C@@H]1CN(CC2=CC=C(F)C=C2)[C@@H](C)CN1C(=O)COC1=CC=C(Cl)C=C1CC(=O)O.Cl.ClCCl is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " C[C@@H]1CN(CC2=CC=C(F)C=C2)[C@@H](C)CN1C(=O)COC1=CC=C(Cl)C=C1CC(=O)NS(C)(=O)=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. Cl.OCCCNC1CCCCC1C(O)C1=CC=CC=C1.[Na+].[OH-] ",
"input": "",
"output": " OCCCNC1CCCCC1=CC1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CC=NC=C1.CC1=CC=C(S(=O)(=O)Cl)C=C1.CC1=NN(C)C(C(=O)NC2=CC(OC3=CC=C(N)N=C3)=CC=C2C)=C1 Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CC1=CC=C(S(=O)(=O)NC2=CC=C(OC3=CC=C(C)C(NC(=O)C4=CC(C)=NN4C)=C3)C=N2)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)=O.CC1(C)S[C@@H]2C(NC(C3=CC=CC=C3)(C3=CC=CC=C3)C3=CC=CC=C3)C(=O)N2C1C1=NN=NN1.CC1=CC=C(S(=O)(=O)O)C=C1.CCOCC.O Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CC1(C)S[C@@H]2C(N)C(=O)N2C1C1=NN=NN1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCOC(=O)C1=C(CBr)NC(N2C=NC=N2)=NC1C1=CC=C(F)C=C1Br.Cl.O=C(O)C1CNCCO1 Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CCOC(=O)C1=C(CN2CCOC(C(=O)O)C2)NC(N2C=NC=N2)=NC1C1=CC=C(F)C=C1Br .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.CCOC(C)=O.COCOC1=CC=CC2=C1C1CC1(C)C(=O)O2.[Al+3].[H-].[Li+] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be COCOC1=CC=CC(O)=C1C1CC1(C)CO .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1CCOC1.CC(C)(C)OC(=O)NCC1CCC(=O)CC1.CCN(CC)S(F)(F)F ",
"input": "",
"output": " CC(C)(C)OC(=O)NCC1CC=C(F)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC(C)(C)O.CC1=CN=CC(C(=O)O)=C1.CCN(C(C)C)C(C)C.[N-]=[N+]=NP(=O)(C1=CC=CC=C1)C1=CC=CC=C1 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CC1=CN=CC(NC(=O)OC(C)(C)C)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. NN1CCCCC1.O=C(O)C1=CN=C(C2CC2)C(C2=CC=CC(Cl)=C2)=N1 ",
"input": "",
"output": " O=C(NN1CCCCC1)C1=CN=C(C2CC2)C(C2=CC=CC(Cl)=C2)=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC1=NN(C)C(NC(=O)OC(C)(C)C)=C1F.ClCCl.O=C(O)C(F)(F)F as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CC1=NN(C)C(N)=C1F .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC1=CC=C(N2N=CC=N2)C(C(=O)O)=C1.CCN(C(C)C)C(C)C.CN(C)C(ON1N=NC2=CC=CC=C21)=[N+](C)C.CN(C)C=O.Cl.F[B-](F)(F)F.NC1CCCC1CC1=CC=C(C(F)(F)F)C=N1 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CC1=CC=C(N2N=CC=N2)C(C(=O)NC2CCCC2CC2=CC=C(C(F)(F)F)C=N2)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C1=CC=NC=C1.CC(=O)OC(C)=O.CC(O)C1=CS[C@@H]2C(NC(=O)CC3=CC=CS3)C(=O)N2C1C(=O)OC(C1=CC=CC=C1)C1=CC=CC=C1.ClCCl as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CC(=O)OC(C)C1=CS[C@@H]2C(NC(=O)CC3=CC=CS3)C(=O)N2C1C(=O)OC(C1=CC=CC=C1)C1=CC=CC=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC#N.CC(C)(C)[O-].CC1=CC=CC=C1.COC(=O)C1=CC=CN1C.[K+] .",
"input": "",
"output": " CN1C=CC=C1C(=O)CC#N ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CCC[N+](CCC)(CCC)CCC.CCOCC.C[C@H](CCCO)[C@H]1CC=C2C3=C(CC[C@@]21C)[C@@]1(C)CC[C@H](O)C(C)(C)[C@@H]1CC3.C[N+]1([O-])CCOCC1.ClCCl.O=[Ru](=O)(=O)[O-] ",
"input": "",
"output": " C[C@H](CCC=O)[C@H]1CC=C2C3=C(CC[C@@]21C)[C@@]1(C)CCC(=O)C(C)(C)[C@@H]1CC3 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CCCCCCCCOC1=CC(C)=C([N+](=O)[O-])C(C)=C1.CO.[Pd] as the reactants and reagents.",
"input": "",
"output": " CCCCCCCCOC1=CC(C)=C(N)C(C)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C1=CC=CC=C1.CC1=CC=C(C(O)=S)C=C1.O=S(Cl)Cl , what product could potentially be produced?",
"input": "",
"output": "The product can be CC1=CC=C(C(=S)Cl)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CC(C)(C)OC(=O)N1CCC(CO)(C2=CC=CC=C2)CC1.CN(C)C=O.C[Si](C)(C)CCOCN1C=C2C=C(Br)C=C(CBr)C2=N1.[H-].[Na+] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CC(C)(C)OC(=O)N1CCC(COCC2=CC(Br)=CC3=CN(COCC[Si](C)(C)C)N=C23)(C2=CC=CC=C2)CC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC1=CC=CC(N=C=O)=C1.COC(=O)CC1=CC(C(=O)C2=CC=CC=C2Cl)=C(N2C(C)=NN=C2CN)S1 .",
"input": "",
"output": " COC(=O)CC1=CC(C(=O)C2=CC=CC=C2Cl)=C(N2C(C)=NN=C2CNC(=O)NC2=CC=CC(C)=C2)S1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with O.O=S(=O)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F.OCC(F)(F)C(F)F.[K+].[OH-] as the reactants and reagents.",
"input": "",
"output": " O=S(=O)(OCC(F)(F)C(F)F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC1(C)OC(C)(C)C(=O)C(C2=CC(Br)=CC=C2C2CC2)C1=O.CC1=CC=CC=C1.O=C([O-])[O-].O=S(=O)([O-])C(F)(F)F.OC1=CC=C(Cl)C=C1Cl.[Cs+].[Cu+2] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC1(C)OC(C)(C)C(=O)C(C2=CC(OC3=CC=C(Cl)C=C3Cl)=CC=C2C2CC2)C1=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " COC1=CC(C(=O)C2=CC=NC3=CC=CC=C23)=CC=C1O.N.O=[N+]([O-])O Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be COC1=CC(C(=O)C2=CC=NC3=CC=CC=C23)=CC([N+](=O)[O-])=C1O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CCCCCCI.COC(=O)C1=CC=CC=C1OCCN1CCC(C2=CNC3=CC=CC=C23)CC1.[H-].[Na+] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CCCCCCN1C=C(C2CCN(CCOC3=CC=CC=C3C(=O)O)CC2)C2=CC=CC=C21 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)(C)N1N=C(C(F)(F)F)C=C1O.CN(C)C=O.FC(F)Cl.O.O=C([O-])[O-].[K+] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CC(C)(C)N1N=C(C(F)(F)F)C=C1OC(F)F .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCO.CCOC(=O)CC(=O)C(F)(F)F.CO.C[O-].N=C(N)C1=CC=CC(Cl)=C1.[Na+] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be O=C1C=C(C(F)(F)F)N=C(C2=CC=CC(Cl)=C2)N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1COCCO1.CC(C)C1=CC(C(C)C)=C(C2=CC=CC=C2P(C2CCCCC2)C2CCCCC2)C(C(C)C)=C1.CCOC(C)=O.CNC(=O)C1=C(C2=CC=C(F)C=C2)OC2=CC(N(C)S(C)(=O)=O)=C(B3OC(C)(C)C(C)(C)O3)C=C12.O.O=C(/C=C/C1=CC=CC=C1)/C=C/C1=CC=CC=C1.[N-]=[N+]=NCC1OC2=CC=C(Cl)N=C2C2=CC3=C(F)C=CC=C3N21.[Pd] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CNC(=O)C1=C(C2=CC=C(F)C=C2)OC2=CC(N(C)S(C)(=O)=O)=C(C3=CC=C4OC(CN=[N+]=[N-])N5C(=CC6=C(F)C=CC=C65)C4=N3)C=C12 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CO.COC(=O)CC1=CC=CC(OC[C@@H]2COC(C)(C)O2)=C1[N+](=O)[O-].[Li+].[OH-] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CC1(C)OC[C@@H](COC2=CC=CC(CC(=O)O)=C2[N+](=O)[O-])O1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1=CC=C([PH](C2=CC=CC=C2)(C2=CC=CC=C2)[Pd]([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)[PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.C1CCOC1.CC1(C)OB(C2=CC=CC3=C2C=CN3)OC1(C)C.NC1=NC=C(Br)C=N1.[Na+].[OH-] as the reactants and reagents.",
"input": "",
"output": " NC1=NC=C(C2=CC=CC3=C2C=CN3)C=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC1=CC=C2N=C(N3CCS(=O)(=O)C4=CC=CC=C4C3)C=C(NC(=O)C3CCCN3C(=O)OC(C)(C)C)C2=C1.CCOC(C)=O.Cl ",
"input": "",
"output": " CC1=CC=C2N=C(N3CCS(=O)(=O)C4=CC=CC=C4C3)C=C(NC(=O)[C@@H]3CCCN3)C2=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. C1CCOC1.COC(=O)C1=CC=CC(C(=O)N(C)C)=N1.O=S(=O)([O-])[O-].[Al+3].[H-].[Li+].[Na+] ",
"input": "",
"output": " CN(C)CC1=CC=CC(CO)=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C1=CC(C2CCNCC2)=CC=N1.CC1=CC(C)=CC(C2=CC3=CC=CC=C3N2)=C1.CCN(CC)CC.CCOC(C)=O.Cl.ClCCl.O=C(Cl)C(=O)Cl as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CC1=CC(C)=CC(C2=C(C(=O)C(=O)N3CCC(C4=CC=NC=C4)CC3)C3=CC=CC=C3N2)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)N.CN1CCCC1=O.O=C(C1=CC=C(C2=CN=CO2)C=C1)N(C1CC1)C1CCN(C2=NC(Cl)=NS2)CC1 Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CC(C)NC1=NSC(N2CCC(N(C(=O)C3=CC=C(C4=CN=CO4)C=C3)C3CC3)CC2)=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C#C[Si](C)(C)C.C1=CC=C(P(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.CCN(CC)CC.CN(C)C=O.CN1C(=O)NC2=CC=CC(Br)=C2C1=O as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CN1C(=O)NC2=CC=CC(C#C[Si](C)(C)C)=C2C1=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC1=CC(C2=NN=C3C4=CC=CC=C4C(OCC4=CC=C(CO)C=N4)=NN23)=NO1.CCN(CC)CC.CS(=O)(=O)Cl.ClCCl is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC1=CC(C2=NN=C3C4=CC=CC=C4C(OCC4=CC=C(COS(C)(=O)=O)C=N4)=NN23)=NO1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CCN(CC)CC.CN(C)C=O.ClCC1=CC=CO1.O=C1C2=CC=CC=C2C(=O)N1O as the reactants and reagents.",
"input": "",
"output": " O=C1C2=CC=CC=C2C(=O)N1OCC1=CC=CO1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC(=O)OCCC1=CC=CC=C1.CC(Cl)Cl.CCCCCCCCCC(=O)Cl.[Al+3].[Cl-] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CCCCCCCC(=O)C1=CC=C(CCOC(C)=O)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C1CCOC1.O.O=C(NC(=S)NC1=CC(I)=CC(I)=C1)C1=CC=CC=C1.[Na+].[OH-] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " NC(=S)NC1=CC(I)=CC(I)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CN(C)C=O.ClCCl.O=S(Cl)Cl.O=[N+]([O-])C1=CC=CC=C1C1=NC2=CC(CO)=CN=C2S1 ",
"input": "",
"output": " O=[N+]([O-])C1=CC=CC=C1C1=NC2=CC(CCl)=CN=C2S1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C1COCCO1.CN.CN1N=C(C2=CC=NC(Cl)=N2)C=C1N , what product could potentially be produced?",
"input": "",
"output": "The product can be CNC1=NC=CC(C2=NN(C)C(N)=C2)=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C#CC1=CC=CC(NS(=O)(=O)C(F)(F)F)=C1.COC(=O)CCC1=NC(I)=CC=C1OCCCC/C=C/C1=CC=C(OC)C=C1 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: COC(=O)CCC1=NC(C#CC2=CC=CC(NS(=O)(=O)C(F)(F)F)=C2)=CC=C1OCCCC/C=C/C1=CC=C(OC)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " BrB(Br)Br.COC1=CC=C(C(=O)C(=O)C2=CC=C(OC)C=C2)C=C1.ClCCl Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be O=C(C(=O)C1=CC=C(O)C=C1)C1=CC=C(O)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC(=O)O.CN(C)C1=CC=C(C2=NC(Cl)=C(CC#N)N2CC2=CC=CC=C2)C=C1.Cl.O is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CN(C)C1=CC=C(C2=NC(Cl)=C(CC(=O)O)N2CC2=CC=CC=C2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC(Cl)Cl.CCCCCC.CCOCC.Cl.ClC1=CC=C(Cl)C=C1.O=C1CCC(=O)O1.[Al+3].[Cl-] ",
"input": "",
"output": " COC(=O)CCC(=O)C1=CC=C(Cl)C(Cl)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " Cl[Fe]Cl.O.O=C([O-])[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO.[Na+].[OH-] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be O=C([O-])C(O)C(O)C(O)C(O)CO.[Fe] .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C1=CC=C(P(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.C1CCOC1.CC(C)(C)OC(=O)N1CC[C@H]1CO.CCOC(=O)/N=N/C(=O)OCC.OC1=CC=C(Cl)N=C1 .",
"input": "",
"output": " CC(C)(C)OC(=O)N1CC[C@H]1COC1=CC=C(Cl)N=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC(=O)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4CC=CC[C@]4(C)[C@H]3[C@@H](OC(=O)CCl)C[C@]12C.ClC(Cl)Cl.O=C(OO)C1=CC=CC(Cl)=C1 , what product could potentially be produced?",
"input": "",
"output": "The product can be CC(=O)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4C[C@@H]5O[C@@H]5C[C@]4(C)[C@H]3[C@@H](OC(=O)CCl)C[C@]12C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1CCOC1.CC(N)(C#N)CCF.Cl.O.O=C(Cl)OCC1=CC=CC=C1.O=C([O-])[O-].[K+] ",
"input": "",
"output": " CC(C#N)(CCF)NC(=O)OCC1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCOC(=O)C(C)N1CCCC(NC(=O)OC(C)(C)C)(NC(=O)OC(C)(C)C)C1=O.COC(=O)NC(C(=O)N1CCCC1C1=NC=C(C2=CC=C(C3=CC=C(C4=CN=C(CN5CCCC(NC(=O)OC(C)(C)C)C5=O)N4)C=C3)C=C2)N1)C(C)C Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CCOC(=O)C(C)N1CCCC(N)C1=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CC(=O)O.CCO.COC1=CC=C(C(OC)C(=O)NCC2=CC=C(C(=N)NO)C=C2)C(O)=C1.[Pd] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " COC1=CC=C(C(OC)C(=O)NCC2=CC=C(C(=N)N)C=C2)C(O)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CO.COC(=O)NCC1=CC=C(Cl)C(C(C)(C)O[SiH2]C(C)(C)C)=C1.[Na+].[OH-] , what product could potentially be produced?",
"input": "",
"output": "The product can be COC(=O)NCC1=CC=C(Cl)C(CO)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CN(C)C=O.N#CC1=CC=C(F)C=C1.NC1=NC=CC=C1O.O=C([O-])[O-].[K+] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be N#CC1=CC=C(OC2=CC=CN=C2N)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1CCOC1.CCCCCC.CCCCCCCCC1(CCCCCCCC)C2=CC(Br)=CC=C2C2=CC=C(Br)C=C21.C[Si](C)(C)Cl.[Li]CCCC ",
"input": "",
"output": " CCCCCCCCC1(CCCCCCCC)C2=CC(Br)=CC=C2C2=CC=C([Si](C)(C)C)C=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CC#N.CCN(CC)CC.COC1=CC=C(CN2CCC(NC(=O)N3CCC(=CC4=CC(F)=CC=C4F)CC3)CC2)C=C1Cl.NC1=CC=CC=N1.O.O=C(N1C=CN=C1)N1C=CN=C1 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: O=C(NC1=CC=CC=N1)N1CCC(NC(=O)N2CCC(=CC3=CC(F)=CC=C3F)CC2)CC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.CC1(C)OB(C2=C3N=CC=CN3N=C2)OC1(C)C.CN(C)C=O.ClC1=CC(Cl)=NC=N1.O=C(/C=C/C1=CC=CC=C1)/C=C/C1=CC=CC=C1.O=P([O-])([O-])[O-].[K+].[Pd] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be ClC1=CC(C2=C3N=CC=CN3N=C2)=NC=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC(C)(C)OC(=O)NC1=CN=C(OCC2CC2)C(C2=CC=C(Cl)C=C2)=N1.O=C(O)C(F)(F)F ",
"input": "",
"output": " NC1=CN=C(OC2CCC2)C(C2=CC=C(Cl)C=C2)=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1CCOC1.CC(=O)OC(C)=O.Cl.NC1=CC=C(C#CC2=C3N=C(C4=CC=C(C(F)(F)F)C=C4)C=C(C(F)(F)F)N3N=C2)C=N1.O.[NH4+].[OH-] ",
"input": "",
"output": " CC(=O)NC1=CC=C(C#CC2=C3N=C(C4=CC=C(C(F)(F)F)C=C4)C=C(C(F)(F)F)N3N=C2)C=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CCOC(=O)C1=CC=C(N2CCC([C@@H](O)C3=CC=CC=C3C3=CC=C(Cl)C=C3)CC2)C=C1.CCOC(=O)C1=CC=C(N2CCC([C@@H](OP(=O)(OCC)OCC)C3=CC=CC=C3C3=CC=C(Cl)C=C3)CC2)C=C1.COP(OC)OC , what product could potentially be produced?",
"input": "",
"output": "The product can be CCOC(=O)C1=CC=C(N2CCC([C@@H](OP(=O)(OC)OC)C3=CC=CC=C3C3=CC=C(Cl)C=C3)CC2)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC(C)(C#N)N=NC(C)(C)C#N.CC1=CC=C([N+](=O)[O-])C=C1C(=O)O.CO.COC(=O)C1=CC([N+](=O)[O-])=CC=C1C.Cl.ClC(Cl)Cl.O=C1CCC(=O)N1Br ",
"input": "",
"output": " COC(=O)C1=CC([N+](=O)[O-])=CC=C1CBr ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CCCCCC(=O)CC(=O)[O-].N#CC1=CC=C(NN)C=C1 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CCCC1=NN(C2=CC=C(C#N)C=C2)C(=O)C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. COC(=O)[C@H](CS)NC(=O)[C@@H](CO)NC(=O)OC(C)(C)C.COC1=CC(O[Si](C)(C)C(C)(C)C)=C(CBr)C(C(=O)OCC2=CC=C([N+](=O)[O-])C=C2)=C1C ",
"input": "",
"output": " COC(=O)[C@@H]1CSCC2=C(O)C=C(OC)C(C)=C2C(=O)OC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.CCCCCC.O=C(Cl)OC(Cl)(Cl)Cl.O=C1N[C@H](C2=CC=CC=C2)CO1.[Li]CCCC Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " O=C(Cl)N1C(=O)OC[C@H]1C1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1COCCO1.CC1(C)C2=CC=CC(P(C3=CC=CC=C3)C3=CC=CC=C3)=C2OC2=C(P(C3=CC=CC=C3)C3=CC=CC=C3)C=CC=C21.CCB(CC)C1=CC=CN=C1.COC1=CC=C(CNC2=CN=C(Cl)C(C(F)(F)F)=C2)C=C1.O=C(/C=C/C1=CC=CC=C1)/C=C/C1=CC=CC=C1.O=P([O-])([O-])[O-].[K+].[Pd] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be COC1=CC=C(CNC2=CN=C(C3=CC=CN=C3)C(C(F)(F)F)=C2)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC(=O)N(C)C.Cl.IC1=CC=CC=C1.O.O=C(O)[C@@H]1CCCN1.O=C([O-])[O-].[Cu]I.[K+] .",
"input": "",
"output": " O=C(O)[C@@H]1CCCN1C1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C1CCOC1.CCN(CC)CC.COCC(=O)Cl.N#CC1=CC=C2C(=C1)C(C1=CC=CC(N)=C1)=NN2C1CCCCO1 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: NC(=O)C1=CC=C2NN=C(C3=CC=CC(N)=C3)C2=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC(=O)NC1=CC(N)=C(C#N)C(Br)=N1.CC(=O)[O-].CC1=CC=CC=C1P(C1=CC=CC=C1C)C1=CC=CC=C1C.CCC[Zn+].CCOC(C)=O.CN(C)C=O.O.[I-].[Pd+2] as the reactants and reagents.",
"input": "",
"output": " CCCC1=NC(NC(C)=O)=CC(N)=C1C#N ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C1COCCO1.C=C(OCC)[Sn](CCCC)(CCCC)CCCC.CC(=O)[O-].CC(C)C1=CC(C(C)C)=C(C2=CC=CC=C2P(C2CCCCC2)C2CCCCC2)C(C(C)C)=C1.COC1=CC=C(CN(CC2=CC=C(OC)C=C2)C2=NC(C)=NC(C3=CC(Cl)=CN=C3NC3=CN=C(OC)C(F)=C3)=N2)C=C1.[Cs+].[F-].[Pd+2] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: COC1=CC=C(CN(CC2=CC=C(OC)C=C2)C2=NC(C)=NC(C3=CC(C(C)=O)=CN=C3NC3=CN=C(OC)C(F)=C3)=N2)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " BrC(Br)(Br)Br.C1=CC=C(P(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.CN(C)C=O.COC1=CC(OC)=C2C(=O)NC(C3=CC=C(OCCO)C=C3)=NC2=C1 Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be COC1=CC(OC)=C2C(=O)NC(C3=CC=C(OCCBr)C=C3)=NC2=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC1=CC=CC=C1C(=O)OCCOC(=O)ON1C(=O)CCC1=O.N[C@H](CO)C(=O)O ",
"input": "",
"output": " CC1=CC=CC=C1C(=O)OCCOC(=O)N[C@H](CO)C(=O)O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC(C)=O.CC1=CC=C(S(=O)(=O)C#C[Si](C)(C)C)C=C1.O=C1CCC(=O)N1Br.O=[N+]([O-])[O-].[Ag+] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC1=CC=C(S(=O)(=O)C#CBr)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CCN(CC)CC.CN(C)C=O.CN1C=NC=C1C(=O)O.Cl.NCC1=CC=CC2=C1C(=O)N(C1CCC(=O)NC1=O)C2=O.O=C(C1=NC=CN1)C1=NC=CN1 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CN1C=NC=C1C(=O)NCC1=CC=CC2=C1C(=O)N(C1CCC(=O)NC1=O)C2=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1CCOC1.CC1=CC=CC2=C1N=C(C1=CC=CC3=C1C1=CC=CC=C1C3=NO)N2.CCO.[Ni] ",
"input": "",
"output": " CC1=CC=CC2=C1N=C(C1=CC=CC3=C1C1=CC=CC=C1C3N)N2 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1CCOC1.COC1=C(/C=C2\\C(=O)NC3=CC=CC(C#CCCC(=O)O)=C23)NC=C1.[Na+].[OH-] ",
"input": "",
"output": " COC1=C(/C=C2\\C(=O)NC3=CC=CC(C#CCCC(=O)[O-])=C23)NC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C1CCOC1.CC(=O)[O-].CC1=NC(Cl)=C2N=CN(C3CCCCO3)C2=N1.O.OB(O)C1=CC(Cl)=CN=C1F.[K+] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CC1=NC(C2=CC(Cl)=CN=C2F)=C2N=CN(C3CCCCO3)C2=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CSC1=CC=C(OCC2=C(C)ON=C2C2=CC=CC=C2)N=C1.ClCCl.O=S(=O)(C1=CC=CC=C1)N1OC1C1=CC=CC=C1 as the reactants and reagents.",
"input": "",
"output": " CC1=C(COC2=CC=C(S(C)=O)C=N2)C(C2=CC=CC=C2)=NO1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC(Br)S(=O)(=O)[O-].CN(C)C=O.NC(=O)CC[C@H](NC(=O)OCC1=CC=CC=C1)C(=O)[O-].[H-].[Na+] , what product could potentially be produced?",
"input": "",
"output": "The product can be N[C@@H](CCC(=O)NCCS(=O)(=O)O)C(=O)O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C(=NC1CCCCC1)=NC1CCCCC1.CCOC(C)=O.O=C(O)COC1=CC=C(CBr)C=C1.OC1=CC=C(Cl)C=C1Cl is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC(=O)OOC1=CC=C(CBr)C=C1C1=CC=C(Cl)C=C1Cl ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CCCCCC.CCOC(C)=O.CCOCCO.Cl.NC1=CC=CC=C1.O.O=C(O)C1=CC=C(Cl)C=C1Br.O=C([O-])[O-].O=[Cu-].[Cu].[K+] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: O=C(O)C1=CC=C(Cl)C=C1NC1=CC=CC=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C.CCO.COCCOCN1N=CC=C1[C@H]1CC[C@@H](OCC2=CC=CC=C2)C[C@@H]1OC(=O)C1=CC=CC=C1.COCCOCN1N=CC=C1[C@H]1C[C@@H](OCC2=CC=CC=C2)CC[C@H]1OC(=O)C1=CC=CC=C1.[Pd] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: COCCOCN1N=CC=C1[C@H]1CC[C@@H](O)C[C@@H]1OC(=O)C1=CC=CC=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C1=CC=C([PH](C2=CC=CC=C2)(C2=CC=CC=C2)[Pd]([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)[PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.CC(C)(C)OC(=O)N1C=CC=C1B(O)O.CC1(C)OC(=O)NC2=CC=C(Br)C=C21.CC1=CC=CC=C1.CCO.O.O=C([O-])O.O=C([O-])[O-].[K+].[Na+] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CC(C)(C)OC(=O)N1C=CC=C1C1=CC=C2NC(=O)OC(C)(C)C2=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C=C(C)[C@@H]1CC[C@]2(N)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC=C(C6=CC=C(C(=O)OC)C=C6)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]12.C=C(C)[C@@H]1CC[C@]2(NC(=O)CCN(C)C)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC=C(C6=CC=C(C(=O)O)C=C6)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]12.O=C(O)CC1=NN=NN1 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: C=C(C)[C@@H]1CC[C@]2(NC(=O)CC3=NN=NN3)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC=C(C6=CC=C(C(=O)O)C=C6)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]12 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CCN(C(C)C)C(C)C.CCN=C=NCCCN(C)C.CN(C)C=O.COC1=CC=C([C@@H](C)N)N=C1.Cl.O=C(O)CC1=CC=C(C2=CC=CC=C2)C=C1.ON1N=NC2=CC=CN=C21 .",
"input": "",
"output": " COC1=CC=C([C@@H](C)NC(=O)CC2=CC=C(C3=CC=CC=C3)C=C2)N=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CCCCN1C(=O)C(C(=O)OCC)=C(O)C2=NC=C(CC3=CC=C(F)C=C3)C=C21.CN(CCN)S(C)(=O)=O as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CCCCN1C(=O)C(C(=O)NCCN(C)S(C)(=O)=O)=C(O)C2=NC=C(CC3=CC=C(F)C=C3)C=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CCOC(=O)C(C)C(C1=CC=C(C(F)(F)F)C=C1)C1=CNC2=C(CSC)C=CC=C12.CSCC1=CC=CC2=C1NC=C2C(CCO)C1=CN=C(Br)S1 as the reactants and reagents.",
"input": "",
"output": " CSCC1=CC=CC2=C1NC=C2C(C1=CC=C(C(F)(F)F)C=C1)C(C)CO ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1=CN2CCNCC2=N1.CC(=O)N(C)C.CCN(CC)CC.COC(=O)C1=C(Cl)N=C(SCC2=CC=CC=C2)N=C1NCC1=CC=C(OC)C(Cl)=C1.O as the reactants and reagents.",
"input": "",
"output": " COC(=O)C1=C(NCC2=CC=C(OC)C(Cl)=C2)N=C(SCC2=CC=CC=C2)N=C1N1CCN2C=CN=C2C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCCCCCCCCCCCCCCC(=O)N(C)CCO.O=C(Cl)C1=CC=CC=C1 Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CCCCCCCCCCCCCCCC(=O)N(C)CCOC(=O)C1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC(=O)O.CCOC(=O)C1(C)CC(C2=CC=C(C)C=C2)=C(C#N)C(=O)N1.Cl ",
"input": "",
"output": " CC1=CC=C(C2=C(C#N)C(=O)NC(C)(C(=O)O)C2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C1CCOC1.C=C(C)CC1=CC=C(Cl)C=C1.CCBr.CCOC(=O)C(C)Br.Cl[Ni]Cl.[Cl-].[MgH2].[NH4+] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: C=C(C)CC1=CC=C(C(C)C(=O)OCC)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.CCCCCC[Mg]Br.CCOCC.CN1CCCC1=O.C[Si](C)(C)[N-][Si](C)(C)C.O=C1N[C@@]2(CC[C@H](C3=CC=C4C=C(OS(=O)(=O)C(F)(F)F)CCC4=C3)C2)CO1.[Li+] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CCCCCCC1=CC2=CC=C([C@H]3CC[C@]4(COC(=O)N4)C3)C=C2CC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCN.CCOC(=O)CC1=CC=C(OCC2=CC=CC=C2)C(C2=CC=C(C(F)(F)F)C=C2C=O)=C1 Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CCNCC1=CC(C(F)(F)F)=CC=C1C1=CC(CC(=O)OCC)=CC=C1OCC1=CC=CC=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. C1CCOC1.CC(=O)O[C@@H](CN(CC1=CC=CC=C1)C1(C)CC2=CC(C)=C(C)C=C2C1)C1=CC=C(OCC2=CC=CC=C2)C([N+](=O)[O-])=C1.CC1=CC=CC=C1 ",
"input": "",
"output": " CC(=O)O[C@@H](CN(CC1=CC=CC=C1)C1(C)CC2=CC(C)=C(C)C=C2C1)C1=CC=C(OCC2=CC=CC=C2)C(N)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C1CCNC1.CC(=O)O.ClC(Cl)Cl.O.O=C1NN=C2C[N+]([O-])=C(C3=CC=CC=C3Cl)C3=NC(Cl)=CC=C3N21 , what product could potentially be produced?",
"input": "",
"output": "The product can be O=C1NN=C2C[N+]([O-])=C(C3=CC=CC=C3Cl)C3=NC(N4CCCC4)=CC=C3N21 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC(=O)O.CC1=CC=C(S(=O)(=O)O)C=C1.COC(=O)CC1=C(C)N(C(=O)C2=CC=C([N+](=O)[O-])C=C2)C2=CC=C(OC)C=C12 , what product could potentially be produced?",
"input": "",
"output": "The product can be COC1=CC=C2C(=C1)C(CC(=O)O)=C(C)N2C(=O)C1=CC=C([N+](=O)[O-])C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC#N.NNC(=O)C1=CC=CC2=CC=CC=C12.O=C(C(Cl)(Cl)Cl)C(Cl)(Cl)Cl ",
"input": "",
"output": " O=C(NNC(=O)C(Cl)(Cl)Cl)C1=CC=CC2=CC=CC=C12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC1(C)CCCCC(C)(C)C1=O.CCBr.CCOCC.[LiH] , what product could potentially be produced?",
"input": "",
"output": "The product can be CCC1(O)C(C)(C)CCCCC1(C)C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC(N)=NO.CCN=C=NCCCN(C)C.CN(C)C=O.COCOC1=CC(C(=O)O)=CC=C1C.O.ON1N=NC2=CC=CC=C21 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: COCOC1=CC(C2=NC(C)=NO2)=CC=C1C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC#N.CCOC(C)=O.FC(F)(F)C1=CC(C2=NC(CCl)=NO2)=CC(C(F)(F)F)=C1.N#CC1=CC=C2NC(CC(F)(F)F)=CC2=C1C(F)(F)F.O=C([O-])[O-].[Cs+] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be N#CC1=CC=C2C(=C1C(F)(F)F)C=C(CC(F)(F)F)N2CC1=NOC(C2=CC(C(F)(F)F)=CC(C(F)(F)F)=C2)=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CN1C=C(CC#N)C2=CC(C3=CC=C(C(F)(F)F)C=C3)=CC=C21.CO.O.[K+].[OH-] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CN1C=C(CC(=O)O)C2=CC(C3=CC=C(C(F)(F)F)C=C3)=CC=C21 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C#CCBr.ClCCl.ON=CC1=CC=CC=C1.[NaH] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: BrCC1=CC(C2=CC=CC=C2)=NO1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CCI.CCOC(=O)C1=CC2=C(C)C(C)=CC(NS(=O)(=O)C3=CC=CS3)=C2N1.CCOC(C)=O.CN(C)C=O.O=C([O-])[O-].[K+] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CCOC(=O)C1=CC2=C(C)C(C)=CC(N(CC)S(=O)(=O)C3=CC=CS3)=C2N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C1COCCO1.CC(C)(C)OC(=O)N1CCO[C@@H](C2=CC=C(NC(=O)C3=CN(C4=CC=C(Br)C=N4)N=N3)C=C2)C1.CCOCC.Cl as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: O=C(NC1=CC=C([C@H]2CNCCO2)C=C1)C1=CN(C2=CC=C(Br)C=N2)N=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC(C)(C(=O)O)C(=O)O.CC(C)N=C=NC(C)C.CCN(C(C)C)C(C)C.CN(C)C=O.ClC1=CC=CC=C1C(Cl)(C1=CC=CC=C1)C1=CC=CC=C1.ClCCl.NCCCC1=CN(C(C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=N1.ON1N=NC2=CC=CN=C21 as the reactants and reagents.",
"input": "",
"output": " CC(C)(C(=O)O)C(=O)NCCCC1=CN(C(C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC1=C(C(=O)O)SC=C1.NCC1=CC=CC(F)=C1 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CC1=C(C(=O)NCC2=CC=CC(F)=C2)SC=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: COC1=CC=C2C(OCC3=NN=C4C=CC(C#N)=CN34)=CC=NC2=C1.O=C([O-])O.O=S(=O)(O)O.[Na+] .",
"input": "",
"output": " COC1=CC=C2C(OCC3=NN=C4C=CC(C(N)=O)=CN34)=CC=NC2=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CCOC(=O)C(CN)C1(C)OCCO1.O=C1OC(=O)C2=C1CCCC2 as the reactants and reagents.",
"input": "",
"output": " CCOC(=O)C(CN1C(=O)C2=C(CCCC2)C1=O)C1(C)OCCO1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CC=C2NCC3=CC=CN3CC2=C1.C1COCCO1.CN(C)C1=CC=CC=C1.O.O=C(Cl)C1=CC=C2C(=C1)CC1=CC=CC=C12.O=C(O)C1=CC=C2C(=C1)CC1=CC=CC=C12.O=S(Cl)Cl Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be O=C(C1=CC=C2C(=C1)CC1=CC=CC=C12)N1CC2=CC=CN2CC2=CC=CC=C21 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC(=O)NC1=CC=C(O)C=C1.CC1=CC=C(S(=O)(=O)OCC2CCC=CO2)C=C1.CN(C)C=O.O.[H-].[Na+] as the reactants and reagents.",
"input": "",
"output": " CC(=O)NC1=CC=C(OCC2CCC=CO2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC#N.CC1=CC=CC=C1N1C=CC2=C(C(N)=NN2)C1=O.O=C1CCC(=O)N1Br ",
"input": "",
"output": " CC1=CC=CC=C1N1C=C(Br)C2=C(C(N)=NN2)C1=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC1(C)OB(C2=CC=C3CNC(=O)C3=C2)OC1(C)C.COC(=O)C1=CC(C2CC2)=C2C(C)=C(Cl)C=CN2C1=O , what product could potentially be produced?",
"input": "",
"output": "The product can be COC(=O)C1=CC(C2CC2)=C2C(C)=C(C3=CC=C4CNC(=O)C4=C3)C=CN2C1=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CCOC(OCC)N1C(=O)C(C2=NC=NC3=CC(OCCCN4CCOCC4)=C(OC)C=C23)C2=CC(OCC3=CC=CC=C3)=CC=C21.CO.Cl.O.O=C(O)C(F)(F)F.[Na+].[OH-] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " COC1=CC2=C(C3C(=O)NC4=CC=C(O)C=C43)N=CN=C2C=C1OCCCN1CCOCC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1=CC=CC=C1.CCCNCCC=O.CSC1=NN=C(N=C=O)S1 as the reactants and reagents.",
"input": "",
"output": " CCCN(CCC=O)C(=O)NC1=NN=C(SC)S1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1CCOC1.C=CCCC(=O)OCC.CC(C)(C)[Si](C)(C)OCCOC1=CC=C(CI)C=C1.CC(C)NC(C)C.[Li]CCCC as the reactants and reagents.",
"input": "",
"output": " C=CCC(CC1=CC=C(OCCO[Si](C)(C)C(C)(C)C)C=C1)C(=O)OCC ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CCCCCN.O=C=NCCCl.O=C[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO , what product could potentially be produced?",
"input": "",
"output": "The product can be CCCCCN(C(=O)NCCCl)C1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCCCCN.O=C=NCCCl.O=C[C@H](O)[C@@H](O)[C@@H](O)[C@H](O)CO Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CCCCCN(C(=O)NCCCl)C1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CCO.COC1=C(F)C=C(CN=C=S)C=C1F.NNC=O , what product could potentially be produced?",
"input": "",
"output": "The product can be COC1=C(F)C=C(CNC(=S)NNC=O)C=C1F .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC(C)(C)C(=O)NCC1=CC=C(Cl)C(C(=O)O)=C1F.CC1(C)CCC(OC2=NC=NC3=C(N)C=CC=C23)CC1.CCN(C(C)C)C(C)C.CN(C)C=O.ClCCl.O=C(Cl)C(=O)Cl ",
"input": "",
"output": " CC1(C)CCC(OC2=NC=NC3=C(NC(=O)C4=C(Cl)C=CC(CNC(=O)C(C)(C)C)=C4F)C=CC=C23)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. C1CCOC1.C1COCCN1.ClCCl.FC1=CC=C(Br)C=C1COCCCCBr ",
"input": "",
"output": " FC1=CC=C(Br)C=C1COCCCCN1CCOCC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C=C(CC(=O)O)C(=O)O.NC1=CC=C(OCC2=CC=CC=C2)C=C1 as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " O=C(O)C1CC(=O)N(C2=CC=C(OCC3=CC=CC=C3)C=C2)C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CCCC1=C(O)C=CC2=C1ON=C2C1=CC=CC=C1.COC(=O)CC1=CC=C2NC(CCO)=CC2=C1 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CCCC1=C(OCCC2=CC3=CC(CC(=O)O)=CC=C3N2)C=CC2=C1ON=C2C1=CC=CC=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC#N.CC1=CC(C(O)(C(F)(F)Cl)C(F)(F)Cl)=CC(C)=C1N.CCOC(=O)CBr.O=C([O-])O.[I-].[K+].[Na+] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CCOC(=O)CNC1=C(C)C=C(C(O)(C(F)(F)Cl)C(F)(F)Cl)C=C1C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1CCCCC1.CC1=CC=CC=C1S(=O)(=O)O.COC(=O)C1CSCC1=O.NC(=O)NC1=CC=CC=C1.O as the reactants and reagents.",
"input": "",
"output": " COC(=O)C1=C(NC(=O)NC2=CC=CC=C2)CSC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC(=O)O.CCOCC1=NC(C(C)(C)O)=C(C(=O)OCC2=C(C)OC(=O)O2)N1CC1=CC=C(C2=CC=CC=C2C2=NN=NN2C(C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1 , what product could potentially be produced?",
"input": "",
"output": "The product can be CCOCC1=NC(C(C)(C)O)=C(C(=O)OCC2=C(C)OC(=O)O2)N1CC1=CC=C(C2=CC=CC=C2C2=NN=NN2)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C=O.CCCCCN1CCN(CC2CC2COC2=CC=C(N)C=C2)CC1.N.O=CC=O ",
"input": "",
"output": " CCCCCN1CCN(CC2CC2COC2=CC=C(N3C=CN=C3)C=C2)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1COCCO1.CC[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC1=CNC=N1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)OC.Cl Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CC[C@H](C)[C@H](N)C(=O)N[C@@H](CC1=CNC=N1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)OC .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC(=O)Cl.CN1C(=O)C(C2=CC=C(Cl)C=C2Cl)=CC2=C1N(C)C1=CC=C(C3=NNC=C3)C=C21 ",
"input": "",
"output": " CC(=O)N1C=CC(C2=CC=C3C(=C2)C2=C(N(C)C(=O)C(C4=CC=C(Cl)C=C4Cl)=C2)N3C)=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C1=CC=C([PH](C2=CC=CC=C2)(C2=CC=CC=C2)[Pd]([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)[PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.C1COCCO1.NC1=CC(Cl)=C(I)C=C1[N+](=O)[O-].O.O=P([O-])([O-])[O-].OB(O)C1=CC=C(Cl)C=C1.[K+] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: NC1=CC(Cl)=C(C2=CC=C(Cl)C=C2)C=C1[N+](=O)[O-] .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CN(C)C=O.O.O=C([O-])[O-].O=C1OC(CBr)=C(C2=CC=CC=C2)C2=CC=CC=C12.SC1=NC=NC2=C1N=CN2.[K+] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " O=C1OC(CSC2=NC=NC3=C2N=CN3)=C(C2=CC=CC=C2)C2=CC=CC=C12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C=C[Sn](CCCC)(CCCC)CCCC.CC(Cl)Cl.COC(=O)C1=NC(Cl)=C(F)C(N)=C1I.Cl[Pd](Cl)([PH](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1)[PH](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1 as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " C=CC1=C(C(=O)OC)N=C(Cl)C(F)=C1N ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C1CCOC1.CCC[N+](=O)[O-].ClCCl.O=C(O)CN(CCN(CC(=O)O)CC(=O)O)CC(=O)O.O=CC1=CC=C([N+](=O)[O-])C=C1.[Li]CCCC as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CCC(C(O)C1=CC=C([N+](=O)[O-])C=C1)[N+](=O)[O-] .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CC1=CC=NC=C1C1=CN=C2C(=C1)C(C=O)=NN2C1CCCCO1.CN(C)C=O.NC1=CC=NC=C1N.S as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CC1=CC=NC=C1C1=CN=C2C(=C1)C(C1=NC3=CC=NC=C3N1)=NN2C1CCCCO1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CN(C)C=O.CO.CSC1=NN2C(Cl)=CC(Cl)=NC2=C1S(=O)(=O)C1=CC=CC=C1.N as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CSC1=NN2C(N)=CC(Cl)=NC2=C1S(=O)(=O)C1=CC=CC=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CN(CCCN(C)C(=O)CC1=CC=C(N)C=C1)C(=O)CO[C@H]1CC2=CC=CC=C2C12CCN(CC[C@@]1(C3=CC=C(F)C=C3)CN(C(=O)C3=CC(C(F)(F)F)=CC(C(F)(F)F)=C3)CO1)CC2.CN(CCN1CCC(OC(=O)NC2=CC=CC=C2C2=CC=CC=C2)CC1)C(=O)CCCCC=O Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CN(CCN1CCC(OC(=O)NC2=CC=CC=C2C2=CC=CC=C2)CC1)C(=O)CCCCCNC1=CC=C(CC(=O)N(C)CCCN(C)C(=O)CO[C@H]2CC3=CC=CC=C3C23CCN(CC[C@@]2(C4=CC=C(F)C=C4)CN(C(=O)C4=CC(C(F)(F)F)=CC(C(F)(F)F)=C4)CO2)CC3)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1=CC=NC=C1.CN(C)P(=O)(N(C)C)N(C)C.COC1=CC=C(Br)C2=C1CCCC2.N ",
"input": "",
"output": " COC1(C#N)CC=CC2=C1CCCC2 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C1COCCO1.CC(C)(C)OC(=O)N1CCOC2=CC=C(Br)C=C2C1.CCO.CCOCC.Cl , what product could potentially be produced?",
"input": "",
"output": "The product can be BrC1=CC=C2OCCNCC2=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C1CCOC1.CC(C)NC(C)C.CC=NC(C)(C)C.CCCCCC.O=C(C1=CC=CC(C(F)(F)F)=C1)C1=CC=CC(C(F)(F)F)=C1.[Li]CCCC .",
"input": "",
"output": " O=CC=C(C1=CC=CC(C(F)(F)F)=C1)C1=CC=CC(C(F)(F)F)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CN(C)C(=O)C1=CC=C2OCC(=O)C=CC2=C1.CNO.CO , what product could potentially be produced?",
"input": "",
"output": "The product can be CON=C1C=CC2=CC(C(=O)N(C)C)=CC=C2OC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CC(=O)OCC1=NC(NC(=O)N[C@H](C)C2=CC=CC=C2)=CC(Cl)=C1C#N.CCO.NN.O as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: C[C@@H](NC(=O)NC1=CC2=C(C(N)=NN2)C(CO)=N1)C1=CC=CC=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CO.COC(=O)C1=CC=C(C2=CC=C(C=O)S2)C=C1.ClCCl.[BH4-].[Na+] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: COC(=O)C1=CC=C(C2=CC=C(CO)S2)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C1=CC=C(P(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.C1CCOC1.CC(C)(C)OC(=O)N=NC(=O)OC(C)(C)C.CC1=C(CCO)N=C(C2=CC=C(C(F)(F)F)C=C2)S1.CCOC(=O)C(CC1=CC=C(O)C=C1OCC)OCC .",
"input": "",
"output": " CCOC(=O)C(CC1=CC=C(OCCC2=C(C)SC(C3=CC=C(C(F)(F)F)C=C3)=N2)C=C1OCC)OCC ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC1=CC=CC=C1N1N=C2C(=CN(CC3=CC=C(N4C=CC=N4)C=C3)C3=C(F)C=CC(F)=C23)C1=O.COC1=CC=C(CN)C=C1.CS(C)=O.O=C([O-])O.O=C([O-])[O-].[Cs+].[Na+] .",
"input": "",
"output": " COC1=CC=C(CN2C=C3C(=NN(C4=CC=CC=C4C)C3=O)C3=C(NCC4=CC=C(N5C=CC=N5)C=C4)C(F)=CC=C32)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CNC1.CC#N.Cl.FC1=CC(N2C(C(Cl)(Cl)Cl)=NC3=CC=CN=C32)=CC=C1Cl.O.O=C([O-])[O-].[K+] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be O=C(C1=NC2=CC=CN=C2N1C1=CC=C(Cl)C(F)=C1)N1CCC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C1CCNC1.C1CCOC1.CCC(C)C(=O)OC1=CC(C)=CC2=CC=C(C)C(CCC3CC(O)CC(OC)O3)=C12.CI.O.[LiH].[Li]CCCC , what product could potentially be produced?",
"input": "",
"output": "The product can be CCC(C)(C)C(=O)OC1CC(C)C=C2C=CC(C)C(CCC3CC(O)CC(OC)O3)C21 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1=CN=C(C2=CC=C3C(=C2)CC[C@@H]3N2CC3(CCNCC3)C2)N=C1.CC(=O)Cl.CC1=CC=C(CC(=O)O)C(C(=O)O)=C1.CCN(CC)CC.Cl as the reactants and reagents.",
"input": "",
"output": " CC1=CC=C(CC(=O)N2CCC3(CC2)CN(C2CCC4=CC(C5=NC=CC=N5)=CC=C42)C3)C(C(=O)O)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC(C)NC(C)C.COC1=CC=CC(N)=C1.O=C(O)C1=CC(F)=C(F)C=C1F.[Li]CCCC ",
"input": "",
"output": " COC1=CC=CC(NC2=CC(F)=C(F)C=C2C(=O)O)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCOC(=O)C1=C(OCC2=CC=CC=C2)C(=O)N(C)C(N2CCC(O)CC2)=N1.O=C(O)C(F)(F)F Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CCOC(=O)C1=C(O)C(=O)N(C)C(N2CCC(OC(=O)C(F)(F)F)CC2)=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1COCCO1.CC(C)(C)OC(=O)N1CC(=O)C1.CC(C)(C)OC(=O)N1CC2(CC(O)CO2)C1.CC(C)(C)OC(=O)N1CCC2(CC(O)CO2)C1.Cl Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be OC1COC2(C[NH2+]C2)C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CCC(=O)Cl.COC1=CC2=C(C=C1O)CCNC2.Cl.ClCCl.O.O=C([O-])[O-].[K+] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CCC(=O)N1CCC2=CC(O)=C(OC)C=C2C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC1=CC=C(S(=O)(=O)O)C=C1.CN(C)C1=CC=C(CN)C=C1.CN(C)C1=CC=C(CNC(=O)NCCCC(=O)NO)C=C1.CN(C)C1=CC=C(N)C=C1.Cl.NCCCCCCC(=O)OCC1=CC=CC=C1 ",
"input": "",
"output": " CN(C)C1=CC=C(NC(=O)NCCCCCCC(=O)NO)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. COC1(C(=O)O)CCCCC1.Cl.N[C@H]1CC[C@H](CCN2CCN(C3=CC=CC4=C3OCO4)CC2)CC1 ",
"input": "",
"output": " COC1(C(=O)N[C@H]2CC[C@H](CCN3CCN(C4=CC=CC5=C4OCO5)CC3)CC2)CCCCC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C1=CC=C(P(C2=CC=CC=C2)[C-]2C=CC=C2)C=C1.COC1=CC=C2N=C(Cl)C(C(F)(F)F)=NC2=C1.COCCOCCO.Cl[Pd]Cl.O.O=C([O-])[O-].OB(O)C1=CC=C(C2=NNN=N2)C=C1.[Fe+2].[K+] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: COC1=CC=C2N=C(C3=CC=C(C4=NNN=N4)C=C3)C(C(F)(F)F)=NC2=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC1=CC=CC=C1C.ClCCl.NC1=CC=C(Br)C=C1O.O.O=C(O)C1=CC=CC=C1.OB(O)O Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be BrC1=CC=C2N=C(C3=CC=CC=C3)OC2=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C#CC1=CC=C(S(=O)(=O)O)C=C1.CCN(CC)CC.CN(C)C=O.CN1N=CC(I)=C1C=O.Cl[Pd](Cl)([PH](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1)[PH](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1.[Cu]I Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CN1N=CC(C#CC2=CC=C(S(N)(=O)=O)C=C2)=C1C=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C1CCOC1.CC(C)(C)OC(=O)NCCOC1=NOC(C2=CC=CC=C2)=C1.CC(C)=O.O=P([O-])(O)O.[K+].[Li]CCCC , what product could potentially be produced?",
"input": "",
"output": "The product can be CC(C)(C)OC(=O)NCCOC1=NOC(C2=CC=CC=C2)=C1C(C)(C)O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C1CCOC1.CCOC(=O)C1=CN=C(OC)C(Br)=C1.CC[BH-](CC)CC.COC1=NC=C(C=O)C=C1Br.[Li+] .",
"input": "",
"output": " COC1=NC=C(CO)C=C1Br ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C1CCOC1.C1CO1.CC(C)[N-]C(C)C.CC1=CC=CC(F)=N1.O.[Li+] .",
"input": "",
"output": " OCCCC1=CC=CC(F)=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCCN1C(N)=C(N)C(=O)N(CCC)C1=O.COC1=CC(C=CC(=O)O)=CC(OC)=C1 Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CCCN1C(=O)C2=C(N=C(/C=C/C3=CC(OC)=CC(OC)=C3)N2)N(CCC)C1=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1CCOC1.CC(C)=O.COC1=CC=C(CNC2=NC=NS2)C(OC)=C1.C[Si](C)(C)[N-][Si](C)(C)C.O=C=O.O=S(=O)(Cl)C1=CC=C2C(Cl)=NC=CC2=C1.[Li+] ",
"input": "",
"output": " COC1=CC=C(CN(C2=NC=NS2)S(=O)(=O)C2=CC=C3C(Cl)=NC=CC3=C2)C(OC)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C1=CC=C([PH](C2=CC=CC=C2)(C2=CC=CC=C2)[Pd]([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)[PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.CC1=CC=CC=C1.CN1CCN(C2=CC=C([N+](=O)[O-])C=C2I)CC1.O.O=C([O-])[O-].OB(O)C1=CC=CC=C1.[Na+] , what product could potentially be produced?",
"input": "",
"output": "The product can be CN1CCN(C2=CC=C([N+](=O)[O-])C=C2C2=CC=CC=C2)CC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1CCOC1.CC(C)O[Si](C)(C)C[C@](O)(C1=CC=C(F)C=C1F)[C@@H](C)N1C=CN(C2=CC=C(OC(F)(F)C(F)F)C=C2)C1=O.CO.O=C([O-])O.OO.[Na+] as the reactants and reagents.",
"input": "",
"output": " C[C@@H](N1C=CN(C2=CC=C(OC(F)(F)C(F)F)C=C2)C1=O)[C@](O)(CO)C1=CC=C(F)C=C1F ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CCOC(C)=O.CO.COC1=CC(F)=CC=C1C1=CC=NC=C1N(C)C(=O)C1=CC(SCCNS(N)(=O)=O)=CC(C(F)(F)F)=C1.O.O=S([O-])([O-])=S.O=S([O-])OO.[K+].[Na+] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " COC1=CC(F)=CC=C1C1=CC=NC=C1N(C)C(=O)C1=CC(C(F)(F)F)=CC(S(=O)(=O)CCNS(N)(=O)=O)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC(=O)OC[C@@H](O)[C@@H](OCC1=CC=CC=C1)[C@H](OC(C)=O)[C@@H](O)C=O.CCO.[H][H].[Pd] ",
"input": "",
"output": " CC(=O)OC[C@@H](O)[C@@H](O)[C@H](OC(C)=O)[C@@H](O)C=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.CC1=CC=CC=C1.CCOCC.COC(=O)[C@H]1CC[C@H](C2=NC=C3C(Cl)=NC=CN32)CC1.C[Mg]Br Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CC(C)(O)[C@H]1CC[C@H](C2=NC=C3C(Cl)=NC=CN32)CC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CN(C)C=O.COC1=CC=C(CNC(=O)CCl)C=C1.Cl.O=C(CN1CCNCC1)C1=CC=CC=C1.O=C([O-])[O-].[K+] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: COC1=CC=C(CNC(=O)CN2CCN(CC(=O)C3=CC=CC=C3)CC2)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C[C@]1(/C=C2\\CCN(CC(F)(F)F)C2=O)[C@H](C(=O)OC(C2=CC=CC=C2)C2=CC=CC=C2)N2C(=O)C[C@H]2S1(=O)=O.[Br-].[K+] .",
"input": "",
"output": " C[C@]1(/C=C2\\CCN(CC(F)(F)F)C2=O)[C@H](C(=O)O)N2C(=O)C[C@H]2S1(=O)=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CCCCC(=O)N(CC1=CC=C(C2=CC=CC=C2C#N)C=C1)[C@H](C(=O)OCC1=CC=CC=C1)C(C)C.CCCC[Sn](CCCC)(CCCC)N=[N+]=[N-] ",
"input": "",
"output": " CCCCC(=O)N(CC1=CC=C(C2=CC=CC=C2C2=NNN=N2)C=C1)[C@H](C(=O)OCC1=CC=CC=C1)C(C)C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC1=CC=C(S(=O)(=O)OCCC2CN(CC3=CC=C(C(F)(F)F)C=C3)C(=O)N2C)C=C1.CCOC(=O)C(C)(CC1=CC=CC(O)=C1)OC1=CC=CC=C1.CN(C)C=O.O=C([O-])[O-].[Cs+] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CCOC(=O)C(C)(CC1=CC=CC(OCCC2CN(CC3=CC=C(C(F)(F)F)C=C3)C(=O)N2C)=C1)OC1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C.C1CCOC1.CO.COC1=CC=C(CC2=CC=CC(C3(OC(C)=O)C[C@H](COCC4=CC=CC=C4)[C@@H](OCC4=CC=CC=C4)[C@H](OCC4=CC=CC=C4)[C@H]3OCC3=CC=CC=C3)=C2)C=C1.[OH-].[Pd+2] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " COC1=CC=C(CC2=CC=CC([C@@H]3C[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)=C2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1CCOC1.CC(C)(C)OC(=O)N1CCNC2=CC=CC=C21.CI.O.[H-].[Na+] ",
"input": "",
"output": " CN1CCN(C(=O)OC(C)(C)C)C2=CC=CC=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C1CCOC1.CC(C)[N-]C(C)C.CCCCC12CCC(=O)C(C)=C1C1=CC=C(OCOC)C=C1C2.CCOC(C)=O.II.[Li+] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CCCCC12CC3=CC(OCOC)=CC=C3C1=C(C)C(=O)C(I)C2 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC#N.CCOC(=O)C1=C(CBr)N2C(=N1)C(=O)NC1=CC(C(F)(F)F)=CC=C12.ClC1=C(Cl)NC=N1.O=C([O-])[O-].[K+] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CCOC(=O)C1=C(CN2C=NC(Cl)=C2Cl)N2C(=N1)C(=O)NC1=CC(C(F)(F)F)=CC=C12 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with ClCC1=CN=CC(Br)=C1.O=S1(=O)CCCN1.[H-].[Na+] as the reactants and reagents.",
"input": "",
"output": " O=S1(=O)CCCN1CC1=CN=CC(Br)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using FC1=CC=C(F)C(CBr)=C1.N#CC1=CC=C(NC2=CN=CN=C2)C=C1 as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " N#CC1=CC=C(N(C2=CN=CN=C2)C2=CC(F)=CC=C2F)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. C1COCCO1.CC1=CC=C2C=CC(Br)=C(O[Si](C)(C)C(C)(C)C)C2=N1 ",
"input": "",
"output": " CC(C)(C)[Si](C)(C)OC1=C(Br)C=CC2=CC=C(C=O)N=C12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CCOC(=O)C1=C(C(O)C2=CC=C(Cl)C=C2)N(C(C)C)C(Br)=N1.CCOC(C)=O.O=CC1=CC=C(Cl)C=N1 ",
"input": "",
"output": " CCOC(=O)C1=C(C(O)C2=CC=C(Cl)C=N2)N(C(C)C)C(Br)=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)OC1=NC=CC2=C1C(C1=CC=CC=C1C(F)(F)F)C1=C(C=CNC1=O)N2.C[O+](C)C.ClCCCl.F[B-](F)(F)F.O=C([O-])O.[K+] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be COC1=NC=CC2=C1C(C1=CC=CC=C1C(F)(F)F)C1=C(C=CN=C1OC(C)C)N2 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CCN(CC1CCCC1)C1=NC(C)=C([N+](=O)[O-])C=C1C#N.CCOC(C)=O.CCOC(OCC)N(C)C.CI.CN(C)C=O.CO.O.[H-].[Na+] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CCN(CC1CCCC1)C1=NC2=C(C=C1C#N)N(C)C=C2 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C1CCOC1.CCOCC.COC(=O)C(Br)CC1=CC=CC=C1.C[Si](C)(C)[N-][Si](C)(C)C.O.O=C(COCC1=CC=CC=C1)N1CCOCC1.[Cl-].[K+].[Na+] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: COC(=O)C(CC1=CC=CC=C1)C(OCC1=CC=CC=C1)C(=O)N1CCOCC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC(C)C(=O)NC1=CC=CC(C2CCNCC2)=C1.CC1(C)COC(CCCBr)OC1 ",
"input": "",
"output": " CC(C)C(=O)NC1=CC=CC(C2CCN(CCCC3OCC(C)(C)CO3)CC2)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CC(=O)C1=CN=C(N2CCN(C3=NC4=CC=C(C(F)(F)F)C=C4N3)CC2)C(Cl)=C1.CO.[BH4-].[Na+] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CC(O)C1=CN=C(N2CCN(C3=NC4=CC=C(C(F)(F)F)C=C4N3)CC2)C(Cl)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC(C)(C)OC(=O)N1C(C2=CC(OS(=O)(=O)C(F)(F)F)=C(Cl)C3=C2C(=O)NC3)=CC2=CC(CN3CCCCC3)=CC=C21.CC1=CC=CC=C1.CC[Zn]CC.COCCOC.O , what product could potentially be produced?",
"input": "",
"output": "The product can be CCC1=CC(C2=CC3=CC(CN4CCCCC4)=CC=C3N2C(=O)OC(C)(C)C)=C2C(=O)NCC2=C1Cl .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C1CCOC1.NNC(=O)CCC1=CC=CC(C(F)(F)F)=C1.O=C(O)C1=CC=C2N=CSC2=C1 as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " O=C(CCC1=CC=CC(C(F)(F)F)=C1)NNC(=O)C1=CC=C2N=CSC2=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CCO.CCOCC.N.OC1CC2=CC=CC=C2C1CCCN1CCCCC1.[LiH] , what product could potentially be produced?",
"input": "",
"output": "The product can be OC1CC2=C(CC=CC2)C1CCCN1CCCCC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC(C)(CC(O)(CC1=CC2=CC(C3=CC=CC=N3)=CC=C2N1S(=O)(=O)C1=CC=CC=C1)C(F)(F)F)C1=CC(Cl)=CC2=C1OCC2.CO.O.[Cl-].[Na+].[OH-] as the reactants and reagents.",
"input": "",
"output": " CC(C)(CC(O)(CC1=CC2=CC(C3=CC=CC=N3)=CC=C2N1)C(F)(F)F)C1=CC(Cl)=CC2=C1OCC2 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C=CCN1C=C(C(O)(C2=CC=C3C(=C2)C=NN3C2=CC=C(F)C=C2)C(F)(F)F)C=C1C(=O)N(C)CC(OC)OC.CCOCC.O=S(=O)(O)O , what product could potentially be produced?",
"input": "",
"output": "The product can be C=CCN1C=C(C(O)(C2=CC=C3C(=C2)C=NN3C2=CC=C(F)C=C2)C(F)(F)F)C2=C1C(=O)N(C)C=C2 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC(=O)CCl.CC1=CC=C(C2CC(=O)CC(=O)C2)S1.CCO.CC[O-].[Na+] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC1=CC=C(C2CC(=O)C3=C(C2)OC=C3C)S1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C1CCNC1.CC(=O)O.CCCCCCSC1=NC(C)=CC(C=O)=N1.CCO.[BH3-]C#N.[Na+] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CCCCCCSC1=NC(C)=CC(CN2CCCC2)=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CNCC(OC)OC.COC(C)(C)C.O.O=C(Cl)CC1=CC=CC=C1.O=C([O-])O.[Na+] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: COC(CN(C)C(=O)CC1=CC=CC=C1)OC .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC1=CC=C(N)C(N)=C1.CCN(CC)CC.CCOP(=O)(C#N)OCC.CCS(=O)(=O)N1CC=C(C2=CN=C(N)C(C(=O)O)=N2)CC1.COCCOC ",
"input": "",
"output": " CCS(=O)(=O)N1CC=C(C2=CN=C(N)C(C3=NC4=CC(C)=CC=C4N3)=N2)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.C=C[Mg]Cl.Cl.O=C(C1=CC=CC=C1)C1=CC=C(C2=CC=CC=C2)C=C1 Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be ClCC=C(C1=CC=CC=C1)C1=CC=C(C2=CC=CC=C2)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCCC[Sn](CCCC)(CCCC)C1=CN=C(C(CCCCCCC2=CC=CC=C2)O[Si](C)(C)C(C)(C)C)O1.COC1=CC=CC=C1I Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be COC1=CC=CC=C1C1=CN=C(C(CCCCCCC2=CC=CC=C2)O[Si](C)(C)C(C)(C)C)O1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C1=CC=C(OCC2=NC3=CC=CC=C3N2)C=C1.CC(C)CBr.CN(C)C=O.O=C([O-])[O-].[K+] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CC(C)CN1C(COC2=CC=CC=C2)=NC2=CC=CC=C21 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC1=CC(Cl)=CC=C1C(CC(=O)C1=CN(C)C(=O)C=C1)C1=CC=C(Br)C=C1.Cl.NO.O=C([O-])O.[Na+] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CC1=CC(Cl)=CC=C1C(C/C(=N\\O)C1=CN(C)C(=O)C=C1)C1=CC=C(Br)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC(C)(C)[Si](C)(C)OCCOCCOCCOCCOCCOCCO.CS(C)=O.O=[N+]([O-])C1=CC2=C(NC3=CC(Cl)=C(Cl)C=C3F)N=CN=C2C=C1F.O=[N+]([O-])C1=CC2=C(NC3=CC(Cl)=C(Cl)C=C3F)N=CN=C2C=C1OCCOCCO.[KH] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " O=[N+]([O-])C1=CC2=C(NC3=CC(Cl)=C(Cl)C=C3F)N=CN=C2C=C1OCCOCCOCCOCCOCCOCCO ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C=CCBr.CC#N.O=[N+]([O-])C1=CC([N+](=O)[O-])=C(O)C([N+](=O)[O-])=C1.OC(C1=CC=CC=C1)(C1=CC=C(Cl)C=C1)C1=NC=CN1.[Na+].[OH-] .",
"input": "",
"output": " C=CCN1C=CN=C1C(O)(C1=CC=CC=C1)C1=CC=C(Cl)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CCOC(=O)N1C(=O)C2(C3=CC=C(Cl)C=C31)C(C1=CC=CC(Cl)=C1)CC(=O)NC2C1=CC=CC=C1Cl.CO.[Na+].[OH-] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: O=C1CC(C2=CC=CC(Cl)=C2)C2(C(=O)NC3=CC(Cl)=CC=C32)C(C2=CC=CC=C2Cl)N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C(=NC1CCCCC1)=NC1CCCCC1.CC(C)(C)OC(=O)NCC(=O)O.CCOC(C)=O.OC1=CC(Cl)=C(Cl)C=C1Cl as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CC(C)(C)OC(=O)NCC(=O)OC1=CC(Cl)=C(Cl)C=C1Cl ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1=CC=C([C@@H]2CO2)C=C1.CC(C)O.NC(=O)C1=CC(OCCNCC2=CC=CC=C2)=CC=C1O ",
"input": "",
"output": " NC(=O)C1=CC(OCCN(CC2=CC=CC=C2)C[C@H](O)C2=CC=CC=C2)=CC=C1O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1COCCO1.C=C[Sn](CCCC)(CCCC)CCCC.ClC1=CC=NC2=CC=C(Br)C=C12 ",
"input": "",
"output": " C=CC1=CC=C2N=CC=C(Cl)C2=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C1CCOC1.CC(C)C[Al+]CC(C)C.CCOC(=O)C1=C(C2=CC=C(Cl)S2)ON=C1.Cl.[H-] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: OCC1=C(C2=CC=C(Cl)S2)ON=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(=O)O.CC(C)(C)OC(=O)NCC1OCCC2=C1C=CS2.CCN(CC)CC.ClC(Cl)Cl.O=C1CCC(=O)N1I Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CC(C)(C)OC(=O)NCC1OCCC2=C1C=C(I)S2 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1COCCO1.CC(C)C1=CC(C(C)C)=C(C2=CC=CC=C2P(C2CCCCC2)C2CCCCC2)C(C(C)C)=C1.CNC(=O)C1=C(C2=CC=C(F)C=C2)OC2=CC(N(C)S(C)(=O)=O)=C(B3OC(C)(C)C(C)(C)O3)C=C12.O.O=C(/C=C/C1=CC=CC=C1)/C=C/C1=CC=CC=C1.O=C1C2=NC(Cl)=CC=C2CN1CC1=CC=C(F)C=C1.[Pd] ",
"input": "",
"output": " CNC(=O)C1=C(C2=CC=C(F)C=C2)OC2=CC(N(C)S(C)(=O)=O)=C(C3=CC=C4CN(CC5=CC=C(F)C=C5)C(=O)C4=N3)C=C12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CCNCCO.N#CC1=CC=CC(NC(=O)NC2=CC=C(S(=O)(=O)NCC3=CC=C(S(N)(=O)=O)C=C3)C=C2)=C1 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CCN(CCO)C(=N)C1=CC=CC(NC(=O)NC2=CC=C(S(=O)(=O)NCC3=CC=C(S(N)(=O)=O)C=C3)C=C2)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC(=O)O.CCC[N+](=O)[O-].CN(C)CC1CC1C1=CC=C2C(C=O)=CNC2=C1.O.O=P([O-])([O-])O.[NH4+].[Na+].[OH-] , what product could potentially be produced?",
"input": "",
"output": "The product can be CN(C)CC1CC1C1=CC=C2C(C#N)=CNC2=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if COC1=CC=C(C=CC=O)C=C1OCC1=C(C)OC(C2=CC=CC=C2)=N1.O=C1COC(=O)N1 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " COC1=CC=C(CCCC2OC(=O)NC2=O)C=C1OCC1=C(C)OC(C2=CC=CC=C2)=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: N.O=C(NC(CC1=CC=C(OC(F)(F)F)C=C1)C(=O)O)C1=CC=C(OCCC(F)(F)F)C=C1 , what product could potentially be produced?",
"input": "",
"output": "The product can be NC(=O)C(CC1=CC=C(OC(F)(F)F)C=C1)NC(=O)C1=CC=C(OCCC(F)(F)F)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC(=O)O.NC(=NO)C1=C(F)C=CC(OCC2=NC3=CC(Cl)=CC=C3S2)=C1F.O=C[O-].[NH4+].[Pd] as the reactants and reagents.",
"input": "",
"output": " N=C(N)C1=C(F)C=CC(OCC2=NC3=CC(Cl)=CC=C3S2)=C1F ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) B1C2CCCC1CCC2.C=CCN(C(=O)C1=CC(Cl)=CC(OCCN(C(=O)OC(C)(C)C)C2=CC=NC=C2)=C1)C1CCCC1.OO.[Na+].[OH-] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CC(C)(C)OC(=O)N(CCOC1=CC(Cl)=CC(C(=O)N(CCCO)C2CCCC2)=C1)C1=CC=NC=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C[C@@H](OC1=CC(C2=CC=C3C(=C2)N(C(=O)OC(C)(C)C)CCN3C)=CC2=C1N(C1CC1)C=N2)[C@H]1CNC(=O)C1.ClCCl.O=C(O)C(F)(F)F as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: C[C@@H](OC1=CC(C2=CC=C3C(=C2)NCCN3C)=CC2=C1N(C1CC1)C=N2)[C@H]1CNC(=O)C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CCNC(=O)NC1=C(F)C=C(B2OC(C)(C)C(C)(C)O2)C=C1F.C[C@H]1COCCN1C1=NC(Cl)=NC2=C1CN(C)C2 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CCNC(=O)NC1=C(F)C=C(C2=NC3=C(CN(C)C3)C(N3CCOC[C@@H]3C)=N2)C=C1F .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC1=C(C(=O)O)C(=O)N(C2=CC=CC=C2)N1C.CCN=C=NCCCN(C)C.ClCCl.NC(=O)C1=CC(OC2=CC=C(N)C(Cl)=C2)=CC=N1.O.ON1N=NC2=CC=CN=C21 Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CC1=C(C(=O)NC2=CC=C(OC3=CC=NC(C(N)=O)=C3)C=C2Cl)C(=O)N(C2=CC=CC=C2)N1C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: O=C(O)C1=CC=C(B(O)O)C=C1.O=C1C=COC2=CC=C(Br)C=C12 .",
"input": "",
"output": " O=C(O)C1=CC=C(C2=CC=C3OC=CC(=O)C3=C2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCN(CC)CC.CCN=C=NCCCN(C)C.C[C@H](C(=O)OC(C)(C)C)N1CC[C@H](NS(=O)(=O)C2=CC=C3C=C(Cl)C=CC3=C2)C1=O.Cl.ClCCl.O=C(NC1CCCNC1)C1=CC=CC=C1.O=C(O)C(F)(F)F.ON1N=NC2=CC=CC=C21 Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be C[C@H](C(=O)N1CCCC(NC(=O)C2=CC=CC=C2)C1)N1CC[C@H](NS(=O)(=O)C2=CC=C3C=C(Cl)C=CC3=C2)C1=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC(=O)O.CCOC(CCl)(OCC)OCC.N#CC[C@H]1CC[C@H](NC2=C(N)C=NC3=C2SC=C3)CC1 ",
"input": "",
"output": " N#CC[C@H]1CC[C@H](N2C(CCl)=NC3=CN=C4C=CSC4=C32)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. Br.CCC1=CC=CC(N)=C1.O=N[O-].O=[SH]O.[Cu]Br.[Na+] ",
"input": "",
"output": " CCC1=CC=CC(Br)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CCO.CCOC(=O)/C=C/C1=CN=C(N2CCN(C3=NC=C(C4=CC=CC(CN(C)C(=O)CNC(=O)OC(C)(C)C)=C4)C=N3)CC2)C(C)=C1.[Pd] as the reactants and reagents.",
"input": "",
"output": " CCOC(=O)CCC1=CN=C(N2CCN(C3=NC=C(C4=CC=CC(CN(C)C(=O)CNC(=O)OC(C)(C)C)=C4)C=N3)CC2)C(C)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1CCOC1.CC1=CC=C(Br)C=C1.CCCCC.CN(C)C(=O)C1=CC=CC(Br)=C1.O.[Li]C(C)(C)C ",
"input": "",
"output": " CC1=CC=C(C(=O)C2=CC=CC(Br)=C2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CC=C(P(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.C1CCOC1.CCOC(=O)N=NC(=O)OCC.O=C1NC(=O)C2=CC=CC=C12.OCC1=CC=CC(C2=CN=C(N3CCOCC3)N=C2)=C1F Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be O=C1C2=CC=CC=C2C(=O)N1CC1=CC=CC(C2=CN=C(N3CCOCC3)N=C2)=C1F .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(=O)O.O.O=[N+]([O-])C1=CN=C(OC2=C(Cl)C=CC=C2Cl)C(Cl)=C1.[Fe] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be NC1=CN=C(OC2=C(Cl)C=CC=C2Cl)C(Cl)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC(C)(C)C(=O)NCC1=CC=C(Cl)C(C(=O)O)=C1F.CCN(C(C)C)C(C)C.CN(C)C=O.ClCCl.NC1=CC=CC2=C(NC3=CC=C(F)C(C(F)(F)F)=C3)N=CN=C12.O=C(Cl)C(=O)Cl ",
"input": "",
"output": " CC(C)(C)C(=O)NCC1=CC=C(Cl)C(C(=O)NC2=CC=CC3=C(NC4=CC=C(F)C(C(F)(F)F)=C4)N=CN=C23)=C1F ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C1CCOC1.C=CC[C@H](C)C=O.CC(=O)C(C)(C)C(OC(C)C)OC(C)C.CC(C)[N-]C(C)C.CCOCC.O.[Li+] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: C=CC[C@H](C)[C@H](O)CC(=O)C(C)(C)C(OC(C)C)OC(C)C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. BrB(Br)Br.COC1=CC=C(C2C3=CC=C(OC)C=C3CCN2C2=CC=CC=C2)C=C1.ClCCl ",
"input": "",
"output": " OC1=CC=C(C2C3=CC=C(O)C=C3CCN2C2=CC=CC=C2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC(=O)Cl.CC1(C)OB(C2=CC=CC3=C2C=NN3)OC1(C)C.NCC1=CC2=NC(Cl)=NC(N3CCOCC3)=C2S1 ",
"input": "",
"output": " CC(=O)NCC1=CC2=NC(C3=CC=CC4=C3C=NN4)=NC(N3CCOCC3)=C2S1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CCNC(=O)NC1=NC=NC2=C1N=CN2C1OC(C=CC(=O)OC)C2OC(C=CC3=CC=CC=C3)OC21.CO.O.O=S(=O)([O-])[O-].[BH4-].[Cu+2].[Na+] ",
"input": "",
"output": " CCNC(=O)NC1=NC=NC2=C1N=CN2C1OC(CCC(=O)OC)C2OC(C=CC3=CC=CC=C3)OC21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC(C)CCC1CCC(N)C1.CC1=NC=CC(Cl)=C1Cl , what product could potentially be produced?",
"input": "",
"output": "The product can be CC1=NC=CC(NC2CCC(CCC(C)C)C2)=C1Cl .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CC(C)(C)OC(=O)NCCNC(=O)C1=NC=CC=C1OC1=CC=CC=C1.Cl.O=C(O)C(F)(F)F as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: NCCNC(=O)C1=NC=CC=C1OC1=CC=CC=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CN(C)C=O.COC(=O)C(C)(C)Br.CSC1=NC=CC(C2=C(I)NN=C2)=N1.O=C([O-])[O-].[K+] , what product could potentially be produced?",
"input": "",
"output": "The product can be COC(=O)C(C)(C)N1C=C(C2=CC=NC(SC)=N2)C(I)=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC(=O)OC(C)=O.CCOCC.CN(C)C1=CC=NC=C1.NC1=NC(O)=C2C=C(I)C=NC2=N1 as the reactants and reagents.",
"input": "",
"output": " CC(=O)NC1=NC(O)=C2C=C(I)C=NC2=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CNCCCCCCN(C)C.CO.O.O=O.O=S(=O)([O-])[O-].OC1=CC=CC=C1O.[Cu+2] ",
"input": "",
"output": " O=C1C=CC=CC1=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C#CC1=CC=C(OC)C=C1.C1CCOC1.CON(C)C(=O)C1=CC(Cl)=CC(Cl)=C1.[Li]CCCC is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " COC1=CC=C(C#CC(=O)C2=CC(Cl)=CC(Cl)=C2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C1CCOC1.CC(C)C[AlH]CC(C)C.COC(=O)C1=CC2=C(SC=C2)S(=O)(=O)N1C1=CC=C(OC)C=C1 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: COC1=CC=C(N2C(CO)=CC3=C(SC=C3)S2(=O)=O)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C=C1CC(=O)O1.CC(=O)OCC1=C(C(=O)O)N2C(=O)[C@@H](N)[C@H]2SC1.CCOC(C)=O.[Na+].[OH-] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC(=O)CC(=O)NC1C(=O)N2C(C(=O)O)=C(COC(C)=O)CS[C@H]12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC(C)=O.O=C(/C=C/Cl)C1CCC2(CCCCC2)CC1.[I-].[Na+] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " O=C(/C=C/I)C1CCC2(CCCCC2)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC1=CC=C(C(=O)N2CC(C3=CC=C(C#N)C=C3)C2)C=C1C1=C(C)N=C(C2(C)CCN(C(=O)OC(C)(C)C)CC2)N1.CC1=CC=C(C(=O)N2CC(C3=CC=C(C#N)C=C3)C2)C=C1C1=C(C)NC(C2CCN(C(=O)OC(C)(C)C)CC2)=N1 Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be COC(=O)N1CCC(C)(C2=NC(C)=C(C3=CC(C(=O)N4CC(C5=CC=C(C#N)C=C5)C4)=CC=C3C)N2)CC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C1CCOC1.CC(=O)S[C@H]1C[C@@H](CC(=O)O)N(C(=O)OCC2=CC=C([N+](=O)[O-])C=C2)C1.CCN(CC)CC.CCO.CCOC(=O)Cl.CCOC(C)=O.CN.Cl as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CNC(=O)C[C@@H]1C[C@H](S)CN1C(=O)OCC1=CC=C([N+](=O)[O-])C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CN2CCN1CC2.CN(C)C(=S)Cl.CN1CCCC1=O.COC1=CC=C(Br)C=C1O.O Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " COC1=CC(Br)=CC=C1OC(=S)N(C)C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CCN(CC)CC.COC(=O)C1=NC=CC=C1N.ClCCl.O=C(Cl)CC1=CC=CC=C1 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: COC(=O)C1=NC=CC=C1NC(=O)CC1=CC=CC=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: Cl.N=C(CCl)N1CCC(=NO)CC1.O.[Na+].[O-]P([O-])([O-])=S .",
"input": "",
"output": " N=C(CS)N1CCC(=NO)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCN(CC)CC.CS(=O)(=O)Cl.Cl.ClCCl.NC1CC(F)(F)C1 Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CS(=O)(=O)NC1CC(F)(F)C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1=CC=C(P(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.CC(=O)[O-].CC(C)(C)OC(=O)NC1=NC=CC=C1B(O)O.CC1=CC=CC=C1.CCCN1N=C2C(N)=NC3=CC=CC=C3C2=C1CC(C)C.CCCO.Cl.O=C([O-])[O-].[Na+].[Pd+2] ",
"input": "",
"output": " CCCN1N=C2C(N)=NC3=NC=CC=C3C2=C1CC(C)C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC1=CC=CC=C1.CCC(=O)O.CCN(CC)CC.CCOC(=O)C1=C(C)C(C(=O)OCC)=C(N)S1.O.[Cl-].[N-]=[N+]=NP(=O)(C1=CC=CC=C1)C1=CC=CC=C1.[Na+] ",
"input": "",
"output": " CCNC(=O)NC1=C(C(=O)OCC)C(C)=C(C(=O)OCC)S1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " COC(=O)C1=CC(C2=CC=C(OC)C=C2)=NC(C2=CC=C(OC)C=C2)=C1N=[N+]=[N-].ClC1=CC=CC=C1Cl Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " COC(=O)C1=CC(C2=CC=C(OC)C=C2)=NC2=C1NC1=CC(OC)=CC=C12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. C1=CNC=N1.CC(C)(C)[Si](C)(C)Cl.CN(C)C=O.O.OCC1=CC=CC=N1 ",
"input": "",
"output": " CC(C)(C)[Si](C)(C)OCC1=CC=CC=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CCCCSC1=CC=C(C(=O)OC)N=C1.ClCCl.O=C(OO)C1=CC=CC(Cl)=C1 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CCCCS(=O)C1=CC=C(C(=O)OC)N=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.CNC(=O)C1=CC2=C(SC=C2)N1C.[Al+3].[H-].[Li+] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CNCC1=CC2=C(SC=C2)N1C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC(=O)NC(C)CC[C@H](NC(=O)OC(C)(C)C)C(=O)O.CCN=C=NCCCN(C)C.CCO.CCOC(C)=O.CN.CN(C)C=O.Cl.ClCCl.O.ON1N=NC2=CC=CC=C21 , what product could potentially be produced?",
"input": "",
"output": "The product can be CNC(=O)[C@H](CCCCNC(C)=O)NC(=O)OC(C)(C)C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C#CC1=CC=C(C2=CN=C(C3CCCN3C(=O)C(NC(=O)OC)C(C)C)N2)C=C1.C1=CC=C([PH](C2=CC=CC=C2)(C2=CC=CC=C2)[Pd]([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)[PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.CC(C)(C)OC(=O)N1C2CCC(C2)C1C1=NC=C(C2=CC=C(Br)C=C2)N1.CCN(CC)CC.CCOC(C)=O.CN(C)C=O.CO.N#N.[Cu]I .",
"input": "",
"output": " COC(=O)NC(C(=O)N1CCCC1C1=NC=C(C2=CC=C(C#CC3=CC=C(C4=CN=C(C5C6CCC(C6)N5C(=O)OC(C)(C)C)N4)C=C3)C=C2)N1)C(C)C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C1CC2CNCC1O2.C[NH+]1C=CN(S(=O)(=O)N2C=CN=C2)C1.Cl.O=S(=O)([O-])C(F)(F)F as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: O=S(=O)(N1CC2CCC(C1)O2)N1C=CN=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC1=CC=NC(Cl)=N1.CC1=NC(C#CC2=CC=NC(Cl)=C2)=CN1 , what product could potentially be produced?",
"input": "",
"output": "The product can be CC1=CC=NC(N2C=C(C#CC3=CC=NC(Cl)=C3)N=C2C)=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1=CC=C2C(C3CCNCC3)=CNC2=C1.C1COCCO1.CN(C)C1(C2=CC=CC=C2)CCC(NC(=O)OC2=CC=CC=C2)CC1 as the reactants and reagents.",
"input": "",
"output": " CN(C)C1(C2=CC=CC=C2)CCC(NC(=O)N2CCC(C3=CNC4=CC=CC=C34)CC2)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " Br.CC(=O)O.COC1=CC=C(NC2=NN(CC3=CC=CC=C3)C=C2)C=C1.O.O=C([O-])O.[Na+] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " OC1=CC=C(NC2=NN(CC3=CC=CC=C3)C=C2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC(C)(C)C(=O)Cl.CC(C)=O.CCN(CC)CC.NC(=O)OC(CCN1CCN(C2=CC=C(O)C=C2)CC1)C1=CC=C(F)C=C1.O , what product could potentially be produced?",
"input": "",
"output": "The product can be CC(C)(C)C(=O)OC1=CC=C(N2CCN(CCC(OC(N)=O)C3=CC=C(F)C=C3)CC2)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC(C)(C)C1=CC=C2C(=C1)CCC2N.CCOCC.O=C=NC1=CC=CC2=CN=CC=C12 , what product could potentially be produced?",
"input": "",
"output": "The product can be CC(C)(C)C1=CC=C2C(=C1)CCC2NC(=O)NC1=CC=CC2=CN=CC=C12 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C=C1CC(=O)O1.CC(=O)[O-].CCOC(C)=O.CC[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@]2(C)[C@H]1OC(=O)CO.ClCCl.[Na+] as the reactants and reagents.",
"input": "",
"output": " CC[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@]2(C)[C@H]1OC(=O)COC(=O)CC(C)=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CCOC(=O)C1=CSC(Br)=N1.CN1C(=O)C2=C(B(O)O)N(COCC[Si](C)(C)C)C=C2N(C)C1=O.CN1C(=O)C2=C(C3=CC=CC(C#N)=C3)N(COCC[Si](C)(C)C)C=C2N(C)C1=O ",
"input": "",
"output": " CCOC(=O)C1=CSC(C2=C3C(=O)N(C)C(=O)N(C)C3=CN2COCC[Si](C)(C)C)=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " NC1=C(Cl)C(Cl)=NC(C(=O)O)=C1Cl.O.[Na+].[OH-] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be NC1=CC(Cl)=NC(C(=O)O)=C1Cl .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. O=C(OO)C1=CC=CC(Cl)=C1.O=C1C2=CC=CC3=C2N(C2=CC(C(F)(F)F)=CC=C2S3)C(=O)N1CCO ",
"input": "",
"output": " O=C1C2=CC=CC3=C2N(C2=CC(C(F)(F)F)=CC=C2S3=O)C(=O)N1CCO ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C1CCOC1.COC(=O)[C@H](CC(=O)Cl)NC(=O)OCC1=CC=CC=C1.Cl[Mg]CC1=CC=CC=C1.[Br-].[Li+] .",
"input": "",
"output": " COC(=O)[C@H](CC(=O)CC1=CC=CC=C1)NC(=O)OCC1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC(=O)O.CO.O=C([O-])O.O=C1OC(C2CCN(C3=CC=C(/N=C/C4=CC=C([N+](=O)[O-])O4)C=C3F)CC2)=NN1CC1=CC=CC=C1.[BH3-]C#N.[Na+] ",
"input": "",
"output": " O=C1OC(C2CCN(C3=CC=C(NCC4=CC=C([N+](=O)[O-])O4)C=C3F)CC2)=NN1CC1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. C(=NC1CCCCC1)=NC1CCCCC1.C1CCOC1.CC(C)(C)O.CN(C)C1=CC=NC=C1.O=C(O)C1=C(CS(=O)(=O)C2=CC=CC=C2)C=CC(C2=COC=C2)=C1O ",
"input": "",
"output": " CC(C)(C)OC(=O)C1=C(CS(=O)(=O)C2=CC=CC=C2)C=CC(C2=COC=C2)=C1O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CCOC(C)=O.O=[N+]([O-])C1=C(Cl)N=C2C=CC=CC2=C1NCC1(O)CCC1.[Pt] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: NC1=C(Cl)N=C2C=CC=CC2=C1NCC1(O)CCC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC(C)N.CC(C)N(C)C1=CC2=C(C=C1Cl)NC(=O)CC(C1=CC=CC(N3N=NC=C3CO)=C1)=N2.CN(C)C=O.ClCCl.O=S(Cl)Cl.[Cl-] ",
"input": "",
"output": " CC(C)NCC1=CN=NN1C1=CC=CC(C2=NC3=CC(N(C)C(C)C)=C(Cl)C=C3NC(=O)C2)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(CC1=CNC2=CC=CC=C12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)O.CCN=C=NCCCN(C)C.CCOC(C)=O.CN(C)C=O.CN1C=CC=C1CCN.ON1N=NC2=CC=CC=C21 Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CN1C=CC=C1CCNC(=O)C(C)(CC1=CNC2=CC=CC=C12)NC(=O)OC1C2CC3CC(C2)CC1C3 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCC(=O)NC1=C(CC2=CC=CC(Cl)=C2)C2=CC(OC)=CC=C2CC1.CO.CP[C@H](C)C1CCCC1P(C1=CC=CC2=CC=CC=C12)C1=CC=CC2=CC=CC=C12.ClC1=CC=CCCCC1.[H][H].[Rh+] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CCC(=O)N[C@H]1CCC2=CC=C(OC)C=C2[C@H]1CC1=CC=CC(Cl)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C1CN2CCN1CC2.C=CC#N.CCOCC.O=CC1=CC(OC(F)(F)F)=CC=C1O as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " N#CC1=CC2=CC(OC(F)(F)F)=CC=C2OC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC(=O)O.CCC1=C(C(=O)[O-])C=CC(NC(=O)CC2=CC=CC=C2)=C1[N+](=O)[O-].CCO.[Fe] ",
"input": "",
"output": " CCOC1=CC=C2N=C(CC3=CC=CC=C3)N=C2C1=C=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CCN(CC)CC.CCOC(C)=O.CN(C)C=O.CN(C1=CC=CC2=C1NC(C1=NCC(CC(=O)O)S1)=C2)S(=O)(=O)C1=CC=CS1.CO.[N-]=[N+]=NP(=O)(C1=CC=CC=C1)C1=CC=CC=C1 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: COC(=O)NCCC1CN=C(C2=CC3=CC=CC(N(C)S(=O)(=O)C4=CC=CS4)=C3N2)S1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C#CCOC.CCNCC.Cl[Pd](Cl)([PH](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1)[PH](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1.I[Cu]I.O=C(NCC1=CC=C(Cl)C=C1)C1=CN=C2SC(I)=CC2=C1O ",
"input": "",
"output": " COCC#CC1=CC2=C(O)C(C(=O)NCC3=CC=C(Cl)C=C3)=CN=C2S1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)OC1=CC(C(=O)O)=CC(OC(C)C)=C1Cl.CCN(C(C)C)C(C)C.COC(=O)C1=CC=C(N)C=C1 Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be COC(=O)C1=CC=C(NC(=O)C2=CC(OC(C)C)=C(Cl)C(OC(C)C)=C2)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CON=C1C[C@@H](C(=O)O)N(C(=O)OC(C)(C)C)C1.NCCCO.O=S(=O)(Cl)C1=CC=C(C2=CC=CC=C2)C=C1 ",
"input": "",
"output": " CON=C1C[C@@H](C(=O)NCCCO)N(S(=O)(=O)C2=CC=C(C3=CC=CC=C3)C=C2)C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " BrBr.CC1=CC=C(C2=C3C=CC=CC3=CC3=CC=CC=C23)C2=CC=CC=C12.CCO.ClCCl Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CC1=CC=C(C2=C3C=CC=CC3=C(Br)C3=CC=CC=C23)C2=CC=CC=C12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1=CC=C2CNCC2=C1.COC(=O)C1=CC=C(N=C=O)C=C1.N#CC1=CC=C2CNCC2=C1 ",
"input": "",
"output": " N#CC1=CC=C2CN(C(=O)NCCCCC3=CC=CC=C3)CC2=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CCNCC.O=C(C1=CC=C(F)C=C1)N1CCCC1CN1CCCC1 as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CCN(CC)C1=CC=C(C(=O)N2CCC[C@H]2CN2CCCC2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CC[C@@H](C(=O)[O-])S(=O)(=NC(=O)C1=CN=CC(C#CC2=CC=CC(NC(=O)C3=CC(C)=NN3C)=C2)=C1)C1=CC=CC=C1.CN as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CNC(=O)C[S@@](=O)(=NC(=O)C1=CN=CC(C#CC2=CC=CC(NC(=O)C3=CC(C)=NN3C)=C2)=C1)C1=CC=CC=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C1=CC=NC=C1.CC(=O)OC(C)=O.CC1=CC(O)=C(C)C=C1N.CCCCCC.CCOC(C)=O as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CC(=O)NC1=CC(C)=C(OC(C)=O)C=C1C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC(N)C(=O)O.CCCCCC(=O)Cl.CCN(CC)CC.C[Si](C)(C)Cl .",
"input": "",
"output": " CCCCCC(=O)NC(C)C(=O)O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses BrC1=CNN=C1.CN(C)C=O.O.O=C1NC(COCC2=CC=CC=C2)C(CI)O1.O=P([O-])([O-])[O-].[K+] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: O=C1NC(COCC2=CC=CC=C2)C(CN2C=C(Br)C=N2)O1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.COC(=O)C1=CC=C(C2=CC=C(F)C=C2)C=C1.Cl.[Al+3].[H-].[Li+] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be OCC1=CC=C(C2=CC=C(F)C=C2)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C#CCNC(=O)C1=C2[C@@H]3CCN3C(=O)C3=C(C=CS3)N2C=N1.CC(=O)O.CCCN.O=C1CCC(=O)N1I as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CCCNCC1=CN=C(C2=C3[C@@H]4CCN4C(=O)C4=C(C=CS4)N3C=N2)O1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. COCC(=O)O.Cl.N[C@H]1CC[C@H](CCN2CCN(C3=CC=CC4=C3OCO4)CC2)CC1 ",
"input": "",
"output": " COCC(=O)N[C@H]1CC[C@H](CCN2CCN(C3=CC=CC4=C3OCO4)CC2)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " COC1=CC(C[P+](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)=CC(OC)=C1OC.COC1=CC=C(C=O)C([N+](=O)[O-])=C1[N+](=O)[O-].ClCCl.[Br-].[H-].[Na+] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be COC1=CC(/C=C\\C2=CC=C(OC)C([N+](=O)[O-])=C2[N+](=O)[O-])=CC(OC)=C1OC .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CN(C)C=O.O=C(NC1C2CC3CC(C2)CC1C3)C1=CC=C(Cl)N=C1Cl.O=C([O-])[O-].SC1CCCC1.[Na+] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: O=C(NC1C2CC3CC(C2)CC1C3)C1=CC=C(Cl)N=C1SC1CCCC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1=CC=C([PH](C2=CC=CC=C2)(C2=CC=CC=C2)[Pd]([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)[PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.CC1=CC=CC=C1.CCO.COC(=O)C1=CC2=CC(Br)=CC=C2S(=O)(=O)CC1.O.O=C([O-])[O-].[K+].[O-]B([O-])OC1=CC=C(Cl)C=C1 as the reactants and reagents.",
"input": "",
"output": " COC(=O)C1=CC2=CC(C3=CC=C(Cl)C=C3)=CC=C2S(=O)(=O)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C1=CC=C2C(=C1)COC21CCNCC1.CC1=NSC(C2=CC=C(Cl)N=N2)=N1.Cl.O=C([O-])[O-].[K+] .",
"input": "",
"output": " CC1=NSC(C2=CC=C(N3CCC4(CC3)OCC3=CC=CC=C34)N=N2)=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC1=CC=C(CCl)C=C1.CC1=CC=C(CN)C=C1.CC1=CC=CC=C1.NCCO.O.OCCCl.[K+].[OH-] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC1=CC=C(CNCCO)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with COCCC(C(=O)O)N1C=C(OC)C(C2=CC(Cl)=CC=C2C#N)=CC1=O.NC1=CC=C2NN=CC2=C1 as the reactants and reagents.",
"input": "",
"output": " COCCC(C(=O)NC1=CC=C2NN=CC2=C1)N1C=C(OC)C(C2=CC(Cl)=CC=C2C#N)=CC1=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CCN1CCCC1(C)N.CCO.CN1C(=O)C2=CC=CC=C2N(C(=O)CCl)C2=NC=CC=C21.Cl.NC1=C(F)C(N)=C(F)C(F)=C1F.O=C([O-])[O-].[Na+] as the reactants and reagents.",
"input": "",
"output": " CCN1CCCC1CNCC(=O)N1C2=CC=CC=C2C(=O)N(C)C2=CC=CN=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC1=CC=C(S(=O)(=O)O)C=C1.CC1=CC=CC=C1.NCC1=CC=CC(CN)=C1.O.O=C(C1=CC(Cl)=CC(C(F)(F)F)=C1)C(F)(F)F ",
"input": "",
"output": " NC(C1=CC(Cl)=CC(C(F)(F)F)=C1)C(F)(F)F ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1=CC=C([PH](C2=CC=CC=C2)(C2=CC=CC=C2)[Pd]([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)[PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.C1COCCO1.O=C(CC(=O)NC1=CC=C(OC2=CC=NC3=C2SC(I)=C3)C(F)=C1)NC1=CC=CC=C1.[O-][N+]1=CC=C(Br)C=C1 ",
"input": "",
"output": " O=C(CC(=O)NC1=CC=C(OC2=CC=NC3=C2SC(C2=CC=CC=[N+]2[O-])=C3)C(F)=C1)NC1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CCN(CC)CC.CNN(C)C(=O)NC1=CC=C(Cl)C=C1.ClC(Cl)Cl.S=C(Cl)Cl as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CN1C(=O)N(C2=CC=C(Cl)C=C2)C(=S)N1C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C1=CC=NC=C1.CC1=CC=C(N)C(O)=C1.CC1=CC=C(S(=O)(=O)Cl)C=C1.ClCCl as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CC1=CC=C(S(=O)(=O)NC2=CC=C(C)C=C2O)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " COC1=CC=C(C[C@@H](NC(=O)OC(C)(C)C)C(=O)O)C=C1.Cl.O=C(OCC1=CC=CC=C1)[C@@H]1CCCN1 Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be COC1=CC=C(C[C@@H](NC(=O)OC(C)(C)C)C(=O)N2CCC[C@H]2C(=O)OCC2=CC=CC=C2)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C1CCOC1.CC(C)(C)OC(=O)NCC1CC1.COCCl.[Li]CCCC .",
"input": "",
"output": " COCN(CC1CC1)C(=O)OC(C)(C)C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CN(C)C=CC(=O)C1=CC=C2C(=C1)C1=C(N(C)C(=O)C(C3=CC=C(Cl)C=C3Cl)=C1)N2C.Cl.NNC1CCCCC1 as the reactants and reagents.",
"input": "",
"output": " CN1C(=O)C(C2=CC=C(Cl)C=C2Cl)=CC2=C1N(C)C1=CC=C(C3=CC=NN3C3CCCCC3)C=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C1CCOC1.CO.COC(=O)C1(CC2=CC=C(C3=CC=CC=C3)C=C2)CCN(C(=O)[C@H](CC2=CC=CS2)NC(=O)OC(C)(C)C)CC1.[Na+].[OH-] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CC(C)(C)OC(=O)N[C@@H](CC1=CC=CS1)C(=O)N1CCC(CC2=CC=C(C3=CC=CC=C3)C=C2)(C(=O)O)CC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CC#N.CCCC1=C(C(=O)O)N=NN1C1=CC=C(C(=O)NCCCC2=CC=CC=C2)C=C1.CCN=C=NCCCN(C)C.CN(C)C=O.NC1CC1.ON1N=NC2=CC=CC=C21 as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CCCC1=C(C(=O)NC2CC2)N=NN1C1=CC=C(C(=O)NCCCC2=CC=CC=C2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1=CC=C(P(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.CC1=CC=CC=C1.CCO.CCOC(=O)C1=CC(C2CC2)=C2C(C)=C(Cl)C=CN2C1=O.CCOC(C)=O.Cl.Cl[Pd]Cl.NC1=CC=CC(B(O)O)=C1.O=C([O-])[O-].[Na+] as the reactants and reagents.",
"input": "",
"output": " CCOC(=O)C1=CC(C2CC2)=C2C(C)=C(C3=CC=CC(N)=C3)C=CN2C1=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CN(C)C=O.COC(=O)C1=CC=C(N)C=C1O.ClCCCBr.O.O=C([O-])[O-].[Cs+] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " COC(=O)C1=CC=C(N)C=C1OCCCCl ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C1CCOC1.CC(C)(C)C1=CC=C(C(=O)Cl)C=C1.CCN(CC)CC.NC1=NC=CS1 .",
"input": "",
"output": " CC(C)(C)C1=CC=C(C(=O)NC2=NCCS2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CC(C)(C)CCN1C(=O)C(C2=NS(=O)(=O)C3=CC(I)=CC=C3N2)=C(O)C2=CC=CN21.CCOC(C)=O.CN(C)C=O.CNCC(=O)O.CNS(C)(=O)=O.O=P([O-])([O-])OP(=O)([O-])OP(=O)([O-])[O-].[Cu]I.[K+] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CN(C1=CC=C2NC(C3=C(O)C4=CC=CN4N(CCC(C)(C)C)C3=O)=NS(=O)(=O)C2=C1)S(C)(=O)=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CCN.O=CC1=CC=CC(C2=CC=NC(NCCC3=CC=C(O)C=C3)=N2)=C1 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CCNCC1=CC=CC(C2=CC=NC(NCCC3=CC=C(O)C=C3)=N2)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(=O)CC(C)C.CCNCC.COC1=CC(C=CC(=O)N[C@H]2CC[C@H](C)CC2)=CC=C1OCCCl Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CCN(CC)CCOC1=CC=C(C=CC(=O)N[C@H]2CC[C@H](C)CC2)C=C1OC .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C=CCN1C(=O)NC2=CC=CC=C2C1=N.CS(C)=O.O.O=C1CCC(=O)N1Br as the reactants and reagents.",
"input": "",
"output": " O=C1NC2=CC=CC=C2C2=NC(CBr)CN12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC#N.CCN(CC1=CC=CC=C1F)C(=O)COC1=CC=C(O)C=C1.CCOC(C)=O.COC(=O)C1=CC=CC=C1CBr.O=C([O-])[O-].[K+] as the reactants and reagents.",
"input": "",
"output": " CCN(CC1=CC=CC=C1F)C(=O)COC1=CC=C(OCC2=CC=CC=C2C(=O)OC)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CN(C)C=O.COCOC1=CC=C(Br)C=C1C(C#N)C1=NC=CC=C1C1OCCO1.O.O=C([O-])[O-].[K+] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " COCOC1=CC=C(Br)C=C1C(=O)C1=NC=CC=C1C1OCCO1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CCOC(=O)C1=C(C)N(S(=O)(=O)C2=CC=CN=C2)C(Br)=C1.COCCOC.O.O=C([O-])[O-].OB(O)C1=CC=CC=C1.[Na+] ",
"input": "",
"output": " CCOC(=O)C1=C(C)N(S(=O)(=O)C2=CC=CN=C2)C(C2=CC=CC=C2)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CCCCCCCCCCC(O)C(=O)N[C@H](/C=C/C(=O)OCC1=CC=CC=C1)CCCC.CCO.N#N.[Pd] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CCCCCCCCCCC(O)C(=O)N[C@@H](CCCC)CCC(=O)O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC1=CC(Cl)=NC(N2CCCCC2)=N1.COC1=CC(N)=CC=C1N1C=NC(C)=C1 .",
"input": "",
"output": " COC1=CC(NC2=CC(C)=NC(N3CCCCC3)=N2)=CC=C1N1C=NC(C)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C1CCOC1.CC1=CC=C(C2=NC3=C(N=C2C2=CC=C(C)C=C2)N(CCCCCCCCC(=O)O)C(=O)CC3)C=C1.[BH3-]N1CCCC1.[Li+] .",
"input": "",
"output": " CC1=CC=C(C2=NC3=C(N=C2C2=CC=C(C)C=C2)N(CCCCCCCCC(=O)O)CCC3)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(=O)C1=CN=C2N=NN(CC3=CC4=CC=CN=C4C=C3F)C2=N1.CC(C)(O)CON Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be C/C(=N\\OCC(C)(C)O)C1=CN=C2N=NN(CC3=CC4=CC=CN=C4C=C3F)C2=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C1=CC=C([PH](C2=CC=CC=C2)(C2=CC=CC=C2)[Pd]([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)[PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.CN(C)C=O.O.O=C([O-])[O-].O=S1(=O)CCN2C=CC=C(Br)C2=N1.OB(O)C1=CC=C(OC2=CC=CC=C2)C=C1.[Na+] .",
"input": "",
"output": " O=S1(=O)CCN2C=CC=C(C3=CC=C(OC4=CC=CC=C4)C=C3)C2=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C1CCOC1.CO.COC(=O)C1=NC(C)=NC=C1S.O=S([O-])OO.[K+] .",
"input": "",
"output": " COC(=O)C1=CC=NC(S(C)(=O)=O)=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C1CCOC1.CC1(C=O)CCCCC1.CN(C)C(=N)N(C)C.COC(=O)C(NC(=O)OCC1=CC=CC=C1)P(=O)(OC)OC is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " COC(=O)/C(=C/C1(C)CCCCC1)NC(=O)OCC1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1COCCO1.COC1=CC=CC=C1B(O)O.ClCCl.N#CC1=CC=C(Br)S1.O.O=C([O-])[O-].[Na+] as the reactants and reagents.",
"input": "",
"output": " COC1=CC=CC=C1C1=CC=C(C#N)S1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C=O.COC(=O)C(C)(C)C1CCCNC1.Cl.O=CO.[Na+].[OH-] ",
"input": "",
"output": " COC(=O)C(C)(C)C1CCCN(C)C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C=O.COC(=O)C(C)(C)C1CCCNC1.Cl.O=CO.[Na+].[OH-] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: COC(=O)C(C)(C)[C@H]1CCCN(C)C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1CCC2=NCCCN2CC1.CCOC(=O)CC(=O)C(C)C.CN(C)C=O.O.[N-]=[N+]=NC1=CC=CC=C1F ",
"input": "",
"output": " CCOC(=O)C1=C(C(C)C)N(C2=CC=CC=C2F)N=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC(C)(C)OC(=O)CN.CC(C)N=C=NC(C)C.CN(C)C=O.O.O=C(O)C1=CC=CC2=C1CCC2=O.ON1N=NC2=CC=CC=C21 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CC(C)(C)OC(=O)CNC(=O)C1=CC=CC2=C1CCC2=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC(=O)O.CC(=O)O[BH-](OC(C)=O)OC(C)=O.CN1CCCC1=O.CO.COC(OC)OC.O=C(NC1=CC=C(OC(F)(F)F)C=C1)NC1=CC=CN=C1OC1=CC=CC2=C1CCNC2.O=CC1CCCCC1 .",
"input": "",
"output": " O=C(NC1=CC=C(OC(F)(F)F)C=C1)NC1=CC=CN=C1OC1=CC=CC2=C1CCN(CC1CCCCC1)C2 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CN1C(CC2(O)C=CC=CC2C(F)(F)F)=CN=C1S.O.O=C([O-])[O-].O=N[O-].O=[N+]([O-])O.[Na+] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CN1C=NC=C1CC1(O)C=CC=CC1C(F)(F)F .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " BrC(Br)(Br)Br.C1=CC=C(P(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.CCCCCCCCCCCCSCCCO.ClCCl Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CCCCCCCCCCCCSCCCBr ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C1=CC=NC=C1.CC(C)(C)OC(=O)N1CCC(C)(C(=O)O)CC1.CCN=C=NCCCN(C)C.COC(=O)C1=CC=C2C=CN(CC3=CC=CC(N)=C3)C(=O)C2=C1.Cl .",
"input": "",
"output": " COC(=O)C1=CC=C2C=CN(CC3=CC=CC(NC(=O)C4(C)CCN(C(=O)OC(C)(C)C)CC4)=C3)C(=O)C2=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1CCOC1.CCOC(=O)C(C)=CC1=CC=C(C(C)C)C=C1.O.[Al+3].[Ce+3].[Cl-].[H-].[Li+] as the reactants and reagents.",
"input": "",
"output": " CC(=CC1=CC=C(C(C)C)C=C1)CO ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. Br.CC(=O)O.CC(C(N)=O)C1=CC=C2SC3=CC=C(F)C=C3CC(=O)C2=C1.CCCCCC ",
"input": "",
"output": " CC(C(=O)O)C1=CC=C2SC3=CC=C(F)C=C3CC(=O)C2=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C1CCNCC1.CCC(C)=O.O=C([O-])[O-].O=C1C2=CC=CC=C2C(=O)N1OCCBr.[I-].[Na+] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " O=C1C2=CC=CC=C2C(=O)N1OCCN1CCCCC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with BrC1=CC=CN=C1OC1=CC=C(NC2=CC=CC=N2)C=C1.CCO.COCCOC.Cl.Cl[Pd](Cl)([PH](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1)[PH](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1.O.O=C(O)O.OB(O)C1=CC=CN=C1 as the reactants and reagents.",
"input": "",
"output": " C1=CC=C(NC2=CC=C(OC3=NC=CC=C3C3=CC=CN=C3)C=C2)N=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)OC(C)C.CCN(CC)CC.CN(C)C=O.CON=C(C(=O)NC1C(=O)N2C(C(=O)O)=CCS[C@H]12)C1=CSC(N)=N1.CS(C)=O.O=C(OCI)C1CCCCC1 Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CON=C(C(=O)NC1C(=O)N2C(C(=O)OCOC(=O)C3CCCCC3)=CCS[C@H]12)C1=CSC(N)=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CCCCCC.CCOCC.CN(C(=O)[C@H](CC1=CN(C(C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=N1)NC(=O)OCC1=CC=CC=C1)[C@@H](CC1=CC=C(OCC2=CC=CC=C2)C=C1)C(=O)NCCOCC1=CC=CC=C1.ClCCl.O=C(O)C(F)(F)F , what product could potentially be produced?",
"input": "",
"output": "The product can be CN(C(=O)C(CC1=CNC=N1)NC(=O)OCC1=CC=CC=C1)C(CC1=CC=C(OCC2=CC=CC=C2)C=C1)C(=O)NCCC1=CC=CC=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CN(C)C=O.O=C([O-])[O-].O=[N+]([O-])C1=CC=C(F)C=C1.OC1=CC=CC2=C1COC2.[K+] .",
"input": "",
"output": " O=[N+]([O-])C1=CC=C(OC2=CC=CC3=C2COC3)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC1=CC=C(C2=C(C3=CC=C(C)C=C3)NC(S)=N2)C=C1.CN(C)C=O.O=[N+]([O-])C1=CC(C(F)(F)F)=CC=C1Cl.[H-].[Na+] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CC1=CC=C(C2=C(C3=CC=C(C)C=C3)NC(SC3=CC=C(C(F)(F)F)C=C3[N+](=O)[O-])=N2)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)(C)C(=O)Cl.CCN(CC)CC.CS(=O)(=O)Cl.Cl.N#CC1=CC=C(N)C=C1.O.O=C(Cl)OCC1=CC=CC=C1.O=C([O-])O.O=C([O-])[O-].[Na+].[OH-] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be N#CC1=CC=C(N2CCC(N)(C(=O)OCC3=CC=CC=C3)C2=O)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CCOC(C)=O.CN(C)C=O.N#CC1=CC=C(N(CCBr)N2C=NN=C2)C=C1.O.O=C([O-])[O-].OC1=CC=C(S)C=C1.[K+] ",
"input": "",
"output": " N#CC1=CC=C(N(CCSC2=CC=C(O)C=C2)N2C=NN=C2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CCN=C=NCCCN(C)C.CNCC1=CC=C(C(C)(C)C2=CC=CC=C2)C=C1.Cl.ClCCl.O=C(O)C1=CC=C2C=CC=NC2=C1O.ON1N=NC2=CC=CC=C21 ",
"input": "",
"output": " CN(CC1=CC=C(C(C)(C)C2=CC=CC=C2)C=C1)C(=O)C1=CC=C2C=CC=C(O)C2=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC(=O)C(C)C.CCO.NNC1=C(F)C2=C(F)C(F)=C(F)C(F)=C2CC(F)=C1F .",
"input": "",
"output": " CC(=NNC1=C(F)C2=C(F)C(F)=C(F)C(F)=C2CC(F)=C1F)C(C)C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)[N-]C(C)C.CCOC(C)=O.CCOCC.O=C1CCN(C(=O)OCC2=CC=CC=C2)CC1.[Cl-].[Li+].[NH4+] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CCOC(=O)CC1(O)CCN(C(=O)OCC2=CC=CC=C2)CC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C=CCOC(=O)N1COC(=O)[C@]12[C@H]1[C@@H](C[C@@H]2F)[C@@H]1C(=O)O.CC(Cl)OC(=O)C(C)C ",
"input": "",
"output": " C=CCOC(=O)N1COC(=O)[C@]12C1[C@@H](C[C@@H]2F)[C@@H]1C(=O)O[C@@H](C)OC(=O)C(C)C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " COC(=O)C1=CC=C(N)C=C1O.Cl.NO.O.O=S(=O)(O)O.O=S([O-])[O-].[Na+].[OH-] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be NC1=CC=C(C(=O)NO)C(O)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC1=CC=C(F)C(N)=C1.CCOC(=O)C1=C2N=CC(C(=O)N3CCC(C4=CC=C(F)C=C4)CC3)=C(Cl)N2N=C1 ",
"input": "",
"output": " CCOC(=O)C1=C2N=CC(C(=O)N3CCC(C4=CC=C(F)C=C4)CC3)=C(NC3=CC(C)=CC=C3F)N2N=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C=O.CC(=O)O.CC(=O)O[BH-](OC(C)=O)OC(C)=O.CO.O=C(NC1=CC=C2CNCCC2=C1)OCC1=CC=CC=C1.O=C([O-])C(F)(F)F.O=C([O-])O.[Na+] , what product could potentially be produced?",
"input": "",
"output": "The product can be CN1CCC2=CC(NC(=O)OCC3=CC=CC=C3)=CC=C2C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. BrC1=CC=CC=C1I.C1=C[CH-]C=C1.C1CCCCC1.C1CCOC1.CCOCC.CN(C)C[C-]1C=CC=C1.[Cl-].[Fe+2].[Li]C(C)CC.[Zn+2] ",
"input": "",
"output": " CN(C)C[C-]1C=CC=C1C1=CC=CC=C1Br ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CCS(=O)(=O)C1=CC=C(OC2=CC(N)=C(N)C=C2OC2=CC=CC=C2C#N)C=N1.COC(=N)C1=CN=CC=N1 ",
"input": "",
"output": " CCS(=O)(=O)C1=CC=C(OC2=CC3=C(C=C2OC2=CC=CC=C2C#N)N=C(C2=CN=CC=N2)N3)C=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C1CCOC1.CO.COC(=O)C1C(=O)C2=CC=CC=C2OC1C1=CC=C(Cl)C(C(F)(F)F)=C1.Cl.O.[BH4-].[Na+] .",
"input": "",
"output": " COC(=O)C1C(O)C2=CC=CC=C2OC1C1=CC=C(Cl)C(C(F)(F)F)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CCOC(C)=O.CN(C)C=O.C[C@H](N)CN1C=CC(C2=CC(F)=C(C#N)C(Cl)=C2)=N1.O.O=C(O)C1=NOC(C2=NOC=C2)=N1 .",
"input": "",
"output": " C[C@@H](CN1C=CC(C2=CC(F)=C(C#N)C(Cl)=C2)=N1)NC(=O)C1=NOC(C2=NOC=C2)=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CC(=O)[O-].CCO.COC(=O)COC1=CC=C(C(C)=O)C=N1.O.[Cl-].[NH3+]O.[Na+] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " COC(=O)COC1=CC=C(C(C)=NO)C=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " NC=O.O.O=C(C1=CC=C(Cl)C=C1)C1=CC=C(N2N=CC(=O)NC2=O)C=C1Cl.O=CO Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " O=CNC(C1=CC=C(Cl)C=C1)C1=CC=C(N2N=CC(=O)NC2=O)C=C1Cl ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCN(CC)CC.CO.ClCCl.O=C(Cl)C1=CC=CC(Cl)=C1.O=C(N(CC1=CC=NC2=CC=CC=C12)[C@H]1CCN[C@H](CC2=CC=CC=C2)C1)C(F)(F)F Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " O=C(C1=CC=C(Cl)C=C1)N1CC[C@H](N(CC2=CC=NC3=CC=CC=C23)C(=O)C(F)(F)F)C[C@H]1CC1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCNCC1.CC1=C(C2=CC=C(OCC3=CC=CC=C3)C=C2)N(CC2=CC=C(OCCCCl)C=C2)C2=CC=C(OCC3=CC=CC=C3)C=C12.CN(C)C=O.O.[I-].[K+] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CC1=C(C2=CC=C(OCC3=CC=CC=C3)C=C2)N(CC2=CC=C(OCCCN3CCCCC3)C=C2)C2=CC=C(OCC3=CC=CC=C3)C=C12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(=O)O.CCOC(=O)C(Cl)SC.ClCCl.O=S(=O)(NCC1CC2=CC=CC=C2C1)C1=CC=C(Cl)C=C1.[Zn] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CCOC(=O)CC1=CC=C2CC(CNS(=O)(=O)C3=CC=C(Cl)C=C3)CC2=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC#N.CC(C)(C)OC(=O)NC1CCNC1.CCC1=C(C(=O)O)C(=O)C2=C(C)C(F)=C(F)C(F)=C2N1C1=CC=C(F)C=C1F.CCN(CC)CC ",
"input": "",
"output": " CC1=C(F)C(N2CCC(N)C2)=C(F)C2=C1C(=O)C(C(=O)O)=CN2C1=CC=C(F)C=C1F ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C1=COC(P(C2=CC=CO2)C2=CC=CO2)=C1.C1COCCO1.CCOC(C)=O.COC1=NC(/C(=C/[C@H]2CCC(=O)N2)C2=CC=C(C(C)(C)C)C=C2)=CC=C1Br.O.O=C(/C=C/C1=CC=CC=C1)/C=C/C1=CC=CC=C1.O=C([O-])[O-].OB(O)C1=CC=CC=C1.[Cs+].[Pd] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: COC1=NC(/C(=C/[C@H]2CCC(=O)N2)C2=CC=C(C(C)(C)C)C=C2)=CC=C1C1=CC=CC=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CCOC(=O)C1=NN(C2=CC=CC=C2)C(C)=C1.C[Al](C)C.ClCCl.NC1=CC=CC(C2CN3CCSC3=N2)=C1 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC1=CC(C(=O)NC2=CC=CC(C3CN4CCSC4=N3)=C2)=NN1C1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC(C)(C)OC(=O)NCC[C@@H](O)C1=CC=CC(O)=C1.CN(C)C=O.CS(=O)(=O)OCC1CCCC(=O)N1.O=C([O-])[O-].[Cs+] , what product could potentially be produced?",
"input": "",
"output": "The product can be CC(C)(C)OC(=O)NCC[C@@H](O)C1=CC=CC(OCC2CCCC(=O)N2)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC1=NNC2=CC=CC(O)=C12.CN(C)C=O.O.O=C([O-])[O-].O=[N+]([O-])C1=CC=C(F)C(F)=C1.[K+] , what product could potentially be produced?",
"input": "",
"output": "The product can be CC1=NNC2=CC=CC(OC3=CC=C([N+](=O)[O-])C=C3F)=C12 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCNCC1.CC(CC1=CNC2=CC=CC=C12)(NC(=O)OCC1C2=CC=CC=C2C2=CC=CC=C21)C(=O)NCCC1=CC=CC=C1.CN(C)C=O Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CC(N)(CC1=CNC2=CC=CC=C12)C(=O)NCCC1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC(C)[Si](O[C@H]1CC[C@@]2(C)C(=CC(C)(O)[C@H]3[C@@H]4CC[C@H]([C@H](C)CCC(=O)O)[C@@]4(C)CC[C@@H]32)C1)(C(C)C)C(C)C.CC1=CC=CC=C1.CO.C[Si](C)(C)C=[N+]=[N-].N#N is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " COC(=O)CC[C@@H](C)[C@H]1CC[C@H]2[C@H]3[C@H](CC[C@]12C)[C@@]1(C)CC[C@H](O[Si](C(C)C)(C(C)C)C(C)C)CC1=CC3(C)O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)(C)NC(=O)CN1C(=O)C(Br)CC(C2=CC=CC=C2)C2=CC=CC=C21.CCOC(C)=O.CN(C)C=O.O.[N-]=[N+]=[N-].[Na+] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CC(C)(C)NC(=O)CN1C(=O)C(N=[N+]=[N-])CC(C2=CC=CC=C2)C2=CC=CC=C21 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CC=C(P(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.CO.C[O-].ClCC1=CC=CC=C1Cl.O=C1OC(O)C2=CC=CC=C12.[Na+] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " O=C(O)C1=CC=CC=C1C=CC1=CC=CC=C1Cl ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC1(C)OB(C2=CC=C3OCOC3=C2)OC1(C)C.COC1=CC=CC(NC2=NC(Cl)=NC3=C2C=NN3C)=C1 Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be COC1=CC=CC(NC2=NC(C3=CC=C4OCOC4=C3)=NC3=C2C=NN3C)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1=CC=NC=C1.C1=CN=C2SC3=C(N4CCNCC4)N=CN=C3C2=C1.CO.ClCCl.O=S(=O)(NC1=NC=CC=N1)C1=CC=C(NC=S)C=C1.[Cl-] ",
"input": "",
"output": " O=S(=O)(NC1=NC=CC=N1)C1=CC=C(NC(=S)N2CCN(C3=NC=NC4=C3SC3=NC=CC=C34)CC2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CC1=NC(Cl)=C2C=CC=CC2=N1.COC1=CN=C(N)C=N1.COC1=CN=C(NC2=NC(C)=NC3=CC=CC=C23)C=N1 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: COC1=CN=C(N(C)C2=NC(C)=NC3=CC=CC=C23)C=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C=C(C)C(=O)OC.CCN(CC)CC.CO.COC1=CC=C(S)C=C1.O.O=S(=O)([O-])O[O-].[K+] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " COC1=CC=C(S(=O)(=O)C(C)C(C)C(=O)O)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C[C@H]1CC2=CC(CCN3CCN(C(=O)OC(C)(C)C)CC3)=CC=C2C(=O)O1.Cl , what product could potentially be produced?",
"input": "",
"output": "The product can be C[C@H]1CC2=CC(CCN3CCNCC3)=CC=C2C(=O)O1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C#CC(=O)C1=NC(Cl)=CC2=C1C(OC)=NN2C(C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1.CC#N.CC(=N)N.Cl.O=C([O-])[O-].[Na+] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: COC1=NN(C(C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C2=CC(Cl)=NC(C3=CC=NC(C)=N3)=C12 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C1CCOC1.CC(C)(C=O)NC(=O)OC(C)(C)C.C[P+](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1.C[Si](C)(C)[N-][Si](C)(C)C.O.[Br-].[K+] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: C=CC(C)(C)NC(=O)OC(C)(C)C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CCN1C(=O)[C@@H]2[C@@H](C(F)(F)F)OC[C@]2(C2=CC=CC=C2F)N=C1NC(=O)OC(C)(C)C.O=[N+]([O-])O.[Na+].[OH-] as the reactants and reagents.",
"input": "",
"output": " CCN1C(=O)[C@@H]2[C@@H](C(F)(F)F)OC[C@]2(C2=CC([N+](=O)[O-])=CC=C2F)N=C1N ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C=CC(C)=O.CC(=O)O.COC1=CC=C(N)C=C1OC.Cl[Fe](Cl)Cl.O Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be COC1=CC2=NC=CC(C)=C2C=C1OC .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " COC(=O)C1=CC=CC2=C1N(C(=O)OC(C)(C)C)CC2.ClCCl.O=C1CCC(=O)N1Br Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be COC(=O)C1=CC(Br)=CC2=C1N(C(=O)OC(C)(C)C)CC2 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC1=CC(N)=CN(C)C1=O.CCOC(=O)C1=NN(C)C=C1C(O)C1=CC=C(Cl)C=C1 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CCOC(=O)C1=NN(C)C=C1C(NC1=CN(C)C(=O)C(C)=C1)C1=CC=C(Cl)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC(=O)Cl.CNCC1=CC=C(C(=O)NC2=NC3=C(OC)C=CC(N4CCOCC4)=C3S2)C=C1 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: COC1=CC=C(N2CCOCC2)C2=C1N=C(NC(=O)C1=CC=C(CN(C)C(C)=O)C=C1)S2 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CN(CCN)CCC(C1=CC=C(F)C=C1)C1=CC=CC=N1.ClCCl.NCCCOC1=CC=CC(CN2CCCCC2)=C1.O=C(N1C=CN=C1)N1C=CN=C1 ",
"input": "",
"output": " CN(CCNC(=O)NCCCOC1=CC=CC(CN2CCCCC2)=C1)CCC(C1=CC=C(F)C=C1)C1=CC=CC=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CCCCC1=NC(Cl)=C(C(=O)OCC)N1CC1=CC=C(C2(C(=O)OCC)CC=CC2)S1.CO.[Na+].[OH-] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CCCCC1=NC(Cl)=C(C(=O)O)N1CC1=CC=C(C2(C(=O)O)CC=CC2)S1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if Cl.NC1COC2=CC=CC=C2C1.O=C([O-])O.[Na+] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " NC1CCC2=CC=CC=C2O1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1NCC12COC2.N#CC1(NC(=O)C2CCC(S(=O)(=O)C3=CC=C(F)C=C3Cl)C2)CC1.O=C(O)C(=O)O ",
"input": "",
"output": " N#CC1(NC(=O)[C@@H]2CC[C@@H](S(=O)(=O)C3=CC=C(N4CC5(COC5)C4)C=C3Cl)C2)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CCN(CC)CC.CNC1=CC=CC=N1.COC1=CC2=NC=NC(OC3=CC=C(N)C(Cl)=C3)=C2C=C1OC.ClC(Cl)Cl.O=C(OC(Cl)(Cl)Cl)OC(Cl)(Cl)Cl.O=C([O-])O.[Na+] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: COC1=CC2=NC=NC(OC3=CC=C(NC(=O)NCCC4=CC=CC=N4)C(Cl)=C3)=C2C=C1OC .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CC1=CC(C)=C(C)[N+]([O-])=C1.O.O=C([O-])O.O=S(=O)(O)O.O=[N+]([O-])O.[NH4+] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CC1=C[N+]([O-])=C(C)C(C)=C1[N+](=O)[O-] ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CN(C)C=O.Cl.N#CC1=CC=C(Cl)N=C1.O=C(O)C1=CC=CC(S)=C1.[H-].[Na+] ",
"input": "",
"output": " N#CC1=CC=C(SC2=CC=CC(C(=O)O)=C2)N=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCCCC1=C(C#N)C=NC2=CC=C(C(=O)OCC)C=C12.[BH4-].[Li+] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CCCCC1C(C#N)=CNC2=CC=C(CO)C=C21 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. C1=CC=C(C2=CC=CC=C2P(C2CCCCC2)C2CCCCC2)C=C1.C1COCCO1.C=C(OCC)C1=CC(COCC(F)(F)F)=NC(Cl)=N1.CC(=O)[O-].COC1=CC(N)=CC=C1N1C=NC(C)=C1.O=C([O-])[O-].[Cs+].[Pd+2] ",
"input": "",
"output": " C=C(OCC)C1=CC(COCC(F)(F)F)=NC(NC2=CC=C(N3C=NC(C)=C3)C(OC)=C2)=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CCOC(=O)C1=CN(C2CCCCC2)C2=NC(S(C)(=O)=O)=NC=C2C1=O.NCCCN1CCOCC1 as the reactants and reagents.",
"input": "",
"output": " CCOC(=O)C1=CN(C2CCCCC2)C2=NC(NCCCN3CCOCC3)=NC=C2C1=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCOC(=O)CC1=CSC(N)=N1.O=S(=O)(Cl)C1=CC=C(F)C(F)=C1F Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CCOC(=O)CC1=CSC(NS(=O)(=O)C2=CC=C(F)C(F)=C2F)=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1CCOC1.COC(=O)C1=CC=C(C(=O)C=C(C2=CC(C(F)(F)F)=CC(C(F)(F)F)=C2)C(F)(F)F)C2=CC=CC=C12.Cl.NO.O.O=S(=O)(O)O.[Na+].[OH-] ",
"input": "",
"output": " COC(=O)C1=CC=C(C2=NOC(C3=CC(C(F)(F)F)=CC(C(F)(F)F)=C3)(C(F)(F)F)C2)C2=CC=CC=C12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CCCN(CC1CC1)C1=CC=C(C(F)(F)F)C=C1C(C)N(CC1=CC(C(F)(F)F)=CC(C(F)(F)F)=C1)C1=NC=C(OCCCC(=O)OCC)C=N1.CCO.[Na+].[OH-] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CCCN(CC1CC1)C1=CC=C(C(F)(F)F)C=C1C(C)N(CC1=CC(C(F)(F)F)=CC(C(F)(F)F)=C1)C1=NC=C(OCCCC(=O)O)C=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C1CCOC1.C1CNC2C(C1)CCCC2N1CCCC1.O=C(N1C=CN=C1)N1C=CN=C1.O=C(O)CC1=CC=C(Cl)C(Cl)=C1 as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " O=C(CC1=CC=C(Cl)C(Cl)=C1)N1CCCC2CCCC(N3CCCC3)C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(=O)Cl.CCO.CCOCC.ClC(Cl)Cl.N.N#CCC1=CC=C(Br)N=C1 Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CCOC(=O)C(=N)C1=CC=C(Br)N=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C#CC1=CC=C2C=NC=C(CC(=O)O)C2=C1.CC(C)CN1C(N)=C(N)C(=O)N(C)C1=O.CCN(C(C)C)C(C)C.CN(C)C=O Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " C#CC1=CC=C2C=NC=C(CC3=NC4=C(N3)C(=O)N(C)C(=O)N4CC(C)C)C2=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C1COCCN1.CC(C)(C)OC(=O)N1C(C2=CC=CC=C2)=C(Br)C2=CC(CBr)=CC([N+](=O)[O-])=C21 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " O=[N+]([O-])C1=CC(CN2CCOCC2)=CC2=C1NC(C1=CC=CC=C1)=C2Br ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C1CCOC1.CCOC(C)=O.ClCCOC1=CC=CC2=C1C=CN2.O=C([O-])O.O=S(=O)(Cl)C1=CC=CC=C1.[H-].[Na+] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " O=S(=O)(C1=CC=CC=C1)N1C=CC2=C(OCCCl)C=CC=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C=C(C1=CC(Cl)=C(C#N)C(Cl)=C1)C(F)(F)F.CC1=CC(C=NO)=CC=C1C(=O)OC(C)(C)C.CCN(CC)CC.CCOC(C)=O.CN(C)C=O.O.O=C1CCC(=O)N1Cl as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CC1=CC(C2=NOC(C3=CC(Cl)=C(C#N)C(Cl)=C3)(C(F)(F)F)C2)=CC=C1C(=O)OC(C)(C)C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC(C)(C)OC(=O)NC[C@@H]1CCN(C2=NC=C(C(=O)NC3=CC=C(OC(F)(F)F)C=C3)C=C2Br)C1.COC1=CC=C(B(O)O)C=N1 as the reactants and reagents.",
"input": "",
"output": " COC1=CC=C(C2=CC(C(=O)NC3=CC=C(OC(F)(F)F)C=C3)=CN=C2N2CC[C@@H](CN)C2)C=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CC=CC=C1.C1CCNCC1.CCC(=O)CC(C)=O.CCO.NC1=NNC=C1 Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CCC1=C2N=C(C)C=C(CC)N2N=C1C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CCOC(=O)C(=NO)C(=O)C1=CC=C(Cl)C=C1.NCC1=CC=C(N2CCCC2)C=C1 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CCOC(=O)C1=C(C2=CC=C(Cl)C=C2)NC(C2=CC=C(N3CCCC3)C=C2)=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC#N.CC(C)(C)OC(=O)N1C=CCC1.NC1=CC=CC=C1.O=CC1=CC=CC=C1.O=S(=O)([O-])C(F)(F)F.[Dy+3] ",
"input": "",
"output": " CC(C)(C)OC(=O)N1CC[C@@H]2[C@@H](C3=CC=CC=C3)NC3=CC=CC=C3[C@@H]21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC1=CC=C(S(=O)(=O)O)C=C1.CC1=CC=CC=C1.CCOC([O-])[O-].O.O=CC1(C=O)CC1.[Na+].[OH-] ",
"input": "",
"output": " CCOC(OCC)C1(C=O)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCCC(=CN(C)C)C(=O)C(=O)OCC.CCCC(=O)C(=O)OCC.CCOC(=O)C1=NC(NC2=CC=C(N3C=NC(C)=C3)C(OC)=C2)=NC=C1CC.CCOC(OCC)N(C)C.COC1=CC(NC(=N)N)=CC=C1N1C=NC(C)=C1.O=[N+]([O-])O Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CCC1=CN=C(NC2=CC=C(N3C=NC(C)=C3)C(OC)=C2)N=C1C(C)(C)O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(=O)OC[C@H]1O[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]1OC(C)=O.COCCOC.C[Si](C)(C)OS(=O)(=O)C(F)(F)F.O=C(NCCN1CCCCC1)C1=NC(NCC(C2=CC=CC=C2)C2=CC=CC=C2)=C2N=CNC2=N1 Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CC(=O)OC[C@H]1O[C@@H](N2C=NC3=C(NCC(C4=CC=CC=C4)C4=CC=CC=C4)N=C(C(=O)NCCN4CCCCC4)N=C32)[C@H](OC(C)=O)[C@@H]1OC(C)=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.CN1C=CN=C1.COCNC(=O)CCCNC(=O)OC(C)(C)C.[Li]CCCC Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CN1C=CN=C1C(=O)CCCNC(=O)OC(C)(C)C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC#N.CCN(CC)CC.CN1C=CC(=O)C(O)=C1C(O)C(F)(F)F.CNC.Cl , what product could potentially be produced?",
"input": "",
"output": "The product can be CN(C)C(C1=C(O)C(=O)C=CN1C)C(F)(F)F .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C1CCOC1.CCN(CC)CC.O=C(Cl)CC(CBr)CBr.O=C1CCC2=CC(OCCCCC3=NN=NN3C3CCCCC3)=CC=C2N1 , what product could potentially be produced?",
"input": "",
"output": "The product can be O=C1CCC2=CC(OCCCCC3=NN=NN3C3CCCCC3)=CC=C2N1C(=O)CC(CBr)CBr .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC1=CNC2=C1N(C)C(=O)N(C)C2=O.CN(C)C=O.O=C(CBr)NC1=NC(C2=CC(F)=C(OCCC(F)(F)F)C(F)=C2)=CS1.[H-].[Na+] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CN1C(=O)C2=C(C=CN2CC(=O)NC2=NC(C3=CC(F)=C(OCCC(F)(F)F)C(F)=C3)=CS2)N(C)C1=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCN(C(C)C)C(C)C.COC1=NC=C(CC2=CNC(=S)NC2=O)C=N1.ClCCCl.FC(F)(F)C1=CC=CC(OC2=CC=C(CCl)C=C2C(F)(F)F)=C1 Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be COC1=NC=C(CC2=CNC(SCC3=CC=C(OC4=CC=CC(C(F)(F)F)=C4)C(C(F)(F)F)=C3)=NC2=O)C=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C1=CC=C(P(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.C1CCOC1.CCOC(C)=O.CN(C)CC1=CC=C(C(CC2=CC(Cl)=C3C=CC=NC3=C2OCC2=CC=CC=C2)N=[N+]=[N-])O1.O as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CN(C)CC1=CC=C(C(N)CC2=CC(Cl)=C3C=CC=NC3=C2OCC2=CC=CC=C2)O1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC(C)(C)C1=CC2=C(C=C1[N+](=O)[O-])OC(=O)C2(C)C.CO.[Pd] as the reactants and reagents.",
"input": "",
"output": " CC(C)(C)C1=CC2=C(C=C1N)OC(=O)C2(C)C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CC1=CC=CC=C1C.F.N#C[S-].[K+] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CC1=CC=C(C(N)=S)C=C1C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.N.O=C(Cl)C1=CC=C(C2=NN(CC3=CC=CC=C3)C3=CC=CC=C23)O1 Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be NC(=O)C1=CC=C(C2=NN(CC3=CC=CC=C3)C3=CC=CC=C23)O1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC(C)(C)O.N#CC(CCN1CCC(OCC2=CC=CC(Cl)=C2)C1)(C1=CC=CC=C1)C1=CC=CC=C1.[K+].[OH-] .",
"input": "",
"output": " NC(=O)C(CCN1CCC(OCC2=CC=CC(Cl)=C2)C1)(C1=CC=CC=C1)C1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CC(=O)O.O=C(O)C1=CC=CC2=C1C1=CC=CC=C1C2=O.[NH-]C1=CC=CC=C1N as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: O=C1C2=CC=CC=C2C2=C1C=CC=C2C1=NC2=CC=CC=C2N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CCOC(=O)C1=CC=C(B(O)O)C=C1.COCCOC.O=C([O-])[O-].O=[N+]([O-])C1=CC=C(Cl)C(Br)=C1.[Cs+] as the reactants and reagents.",
"input": "",
"output": " CCOC(=O)C1=CC=C(C2=CC([N+](=O)[O-])=CC=C2Cl)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C1=CC=CC=C1.CO.ClC(Cl)Cl.O=C(C1=CC=CS1)N1CC1.OC1(C2=CC=C(Cl)C=C2)CCNCC1 as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " O=C(NCCN1CCC(O)(C2=CC=C(Cl)C=C2)CC1)C1=CC=CS1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. C1=CC=NC=C1.COC1=C(N)C(=O)C1=O.NCCCOC1=CC(CN2CCCCC2)=CC=N1 ",
"input": "",
"output": " NC1=C(NCCCOC2=CC(CN3CCCCC3)=CC=N2)C(=O)C1=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1CCOC1.CC1=NC=CN1C1=CC=C(Br)S1.CCCC[Sn](Cl)(CCCC)CCCC.[Cl-].[Li]CCCC.[NH4+] ",
"input": "",
"output": " CCCC[Sn](CCCC)(CCCC)C1=CC=C(N2C=CN=C2C)S1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C1CCOC1.CCCC[N+](CCCC)(CCCC)CCCC.COC(=O)CC1=CC=C(CBr)C=C1.C[Si](C)(C)OC(C#N)C1=CC=CN=C1.[Cl-].[F-].[Na+] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " COC(=O)CC1=CC=C(CC(=O)C2=CC=CN=C2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CCO.CCOC1=C(O)C(=O)O[C@@H]1[C@@H](O)C(O)=C(C)C.O ",
"input": "",
"output": " CCOC1=C(O)C(=O)O[C@@H]1[C@@H](O)CO ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC1=CC(Br)=CC=C1N.Cl.Cl[Sn]Cl.O=N[O-].[Na+].[OH-] as the reactants and reagents.",
"input": "",
"output": " CC1=CC(Br)=CC=C1NN ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CI.O=C(CC(C1=CC=C(Br)C=C1)C1=CC=CC=C1Cl)C1=CNC(=O)C=C1.O=C([O-])[O-].[K+] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CN1C=C(C(=O)CC(C2=CC=C(Br)C=C2)C2=CC=CC=C2Cl)C=CC1=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CC#N.CC(C)N1C(=O)C(Cl)=C(C2=CC=CC=C2)S1(=O)=O.CC(C)OC1=CC=C(N)C=C1 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CC(C)OC1=CC=C(NC2=C(C3=CC=CC=C3)S(=O)(=O)N(C(C)C)C2=O)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " O=C1CC2=CC=CC=C2N1.O=CC1=CC(Cl)=C2C=NNC2=C1 Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be O=C1NC2=CC=CC=C2/C1=C\\C1=CC(Cl)=C2C=NNC2=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC(=O)N(C)C1=CC(C(=O)C=CN(C)C)=CC=C1C.CC(=O)O.CCOC(C)=O.NC1=C(C(=O)C2=CC=CS2)C=NN1 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC(=O)N(C)C1=CC(C2=CC=NC3=C(C(=O)C4=CC=CS4)C=NN23)=CC=C1C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CN(C)C=O.COC(=O)CN.COC1=CC=C(OC2=C(Cl)C(F)=NC(F)=C2Cl)C=C1Br.Cl.O.O=C([O-])[O-].[Cl-].[K+].[Na+] .",
"input": "",
"output": " COC(=O)CNC1=NC(F)=C(Cl)C(OC2=CC=C(OC)C(Br)=C2)=C1Cl ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses NC1=CN=C2C(=C1)C=NN2C1CCOCC1.O=CC1CCOC1 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: NC1=CN=C2C(=C1)C=NN2CC1CCOC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C1=CC=NC=C1.C=CC[C@@]1(C)C[C@H](C2=CC=CC(Cl)=C2)[C@@H](C2=CC=C(Cl)C=C2)N([C@@H](CC)CNCC(F)(F)F)C1=O.CN(C)C1=CC=NC=C1.CS(=O)(=O)Cl.ClCCCl , what product could potentially be produced?",
"input": "",
"output": "The product can be C=CC[C@@]1(C)C[C@H](C2=CC=CC(Cl)=C2)[C@@H](C2=CC=C(Cl)C=C2)N([C@@H](CC)CN(CC(F)(F)F)S(C)(=O)=O)C1=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses COC1=CC=C(C2=NC(C)(C3=CC=C(Cl)C=C3)C(C)(C3=CC=C(Cl)C=C3)N2C(=O)Cl)C(OC(C)C)=C1.O=C1CNCCN1 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: COC1=CC=C(C2=N[C@@](C)(C3=CC=C(Cl)C=C3)[C@@](C)(C3=CC=C(Cl)C=C3)N2C(=O)N2CCNC(=O)C2)C(OC(C)C)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1=CC=C([PH](C2=CC=CC=C2)(C2=CC=CC=C2)[Pd]([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)[PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.COC1=CC=C(B(O)O)C=N1.COCCOC.CSC1=NC(Cl)=CC(Cl)=N1.O.O=C([O-])[O-].[Cs+] ",
"input": "",
"output": " COC1=CC=C(C2=CC(Cl)=NC(SC)=N2)C=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. BrC1=CSC=C1Br.C#CCCCCCC.C1=CC=C(P(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.CCNCC.I[Cu]I ",
"input": "",
"output": " CCCCCCC#CC1=CSC=C1Br ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC(=O)[O-].CC(C)(C)O[Na].CC(C)(C)P.CCCCCC.CCOC(C)=O.COC1=C(C)C(C)=C2NCC3(CCC3)C(=O)C2=C1C.ClC1=CC=C(I)C=C1.[Pd+2] ",
"input": "",
"output": " COC1=C(C)C(C)=C2C(=C1C)C(=O)C1(CCC1)CN2C1=CC=C(Cl)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC1(C)OCCN2C1=NC(C(=O)O)=C(OCC1=CC=CC=C1)C2=O.NCC1=CC=C(F)C=C1I is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC1(C)OCCN2C1=NC(C(=O)NCC1=CC=C(F)C=C1I)=C(OCC1=CC=CC=C1)C2=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1=CC=C([PH](C2=CC=CC=C2)(C2=CC=CC=C2)[Pd]([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)[PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.C1COCCO1.CC1=C(Br)C(F)=C2OC(C3CC3)=NC2=C1C#N.CCOC(C)=O.O=P([O-])([O-])[O-].OB(O)C1=CC=CC(F)=C1F.[Cl-].[K+].[NH4+] ",
"input": "",
"output": " CC1=C(C2=CC=CC(F)=C2F)C(F)=C2OC(C3CC3)=NC2=C1C#N ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)(C)OC(=O)N1CC[C@@H](NC2=CC=C(CN3C(=O)C4(COC5=CC6=C(C=C54)OCO6)C4=CC=CC=C43)C=C2)C1.ClCCl.O=C(O)C(F)(F)F.[Na+].[OH-] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be O=C1N(CC2=CC=C(N[C@@H]3CCNC3)C=C2)C2=CC=CC=C2C12COC1=CC3=C(C=C12)OCO3 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. COC1=CC=CC2=C1NC=C(C(=O)C1CCCCC1)C2=O.ClC(Cl)Cl.O=P(Cl)(Cl)Cl ",
"input": "",
"output": " COC1=CC=CC2=C(Cl)C(C(=O)C3CCCCC3)=CN=C12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C1CCNCC1.CCO.O=C1CNC(=O)N1.O=CC1=C2N=C(NC3=CC=CC(Cl)=C3)C=CN2N=C1 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: O=C1NC(=O)C(=CC2=C3N=C(NC4=CC=CC(Cl)=C4)C=CN3N=C2)N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1COCCN1.C1COCCO1.ClC1=NC2=CC=NN2C(Cl)=C1 ",
"input": "",
"output": " ClC1=NC2=CC=NN2C(N2CCOCC2)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C1CCOC1.CC(=O)C1CCCCC1NC(=O)OCC1=CC=CC=C1.CCOC(C)=O.Cl.O.[Li+].[OH-] , what product could potentially be produced?",
"input": "",
"output": "The product can be O=C(NC1CCCCC1C(=O)O)OCC1=CC=CC=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C1=CC=C(CC2CO2)C=C1.CC(C)O.O=C(NCC1CCNCC1)C1=CNN=C1 .",
"input": "",
"output": " O=C(NCC1CCN(CC(O)CC2=CC=CC=C2)CC1)C1=CNN=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CN(C)C=O.C[C@@]1(O)[C@H](O)[C@@H](CO)O[C@H]1N1C=CC2=C(NO)N=CN=C21.O=C1CCC(=O)N1Cl ",
"input": "",
"output": " C[C@@]1(O)[C@H](O)[C@@H](CO)O[C@H]1N1C=C(Cl)C2=C(NO)N=CN=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. C1COCCN1.CCOC(=O)C1=CN=C(NCCNC2=CC=C(C(=O)Cl)C=N2)N=C1C1=CC=C(C#N)C=C1.ClCCl ",
"input": "",
"output": " CCOC(=O)C1=CN=C(NCCNC2=CC=C(C(=O)N3CCOCC3)C=N2)N=C1C1=CC=C(C#N)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CCO.CN.CSCOC1=CC=CC(C=O)=C1 .",
"input": "",
"output": " CN=CC1=CC=CC(OCSC)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1=CC=C(C(C2=CC=CC=C2)[C@@H]2C[C@H]3O[C@H]3CO2)C=C1.COC1=CC=C(CN)C(OC)=C1 as the reactants and reagents.",
"input": "",
"output": " COC1=CC=C(CN[C@@H]2CO[C@H](C(C3=CC=CC=C3)C3=CC=CC=C3)C[C@H]2O)C(OC)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CCCCCC.CCOC(C)=O.CO.O=C([O-])[O-].O=CC1=CC=C(CO)O1.[C-]#[N+]CS(=O)(=O)C1=CC=C(C)C=C1.[K+] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " OCC1=CC=C(C2=CN=CO2)O1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1COCCO1.CC(O)S.CCC[C@H](NC(=O)[C@H](CC1=CNC2=CC=CC=C12)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C(N)=O)C1=CC=CC=C1.Cl ",
"input": "",
"output": " CCC[C@H](NC(=O)[C@@H](N)CC1=CNC2=CC=CC=C12)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C(N)=O)C1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C(=O)O)C1=CC=C2OC(CC3=CC=C(Cl)C(Cl)=C3)=NC2=C1.CCO.[Na+].[OH-] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CC(C(=O)O)C1=CC=C2OC(CC3=CC=C(Cl)C=C3)=NC2=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CCO.CCOC(=O)C1=CC=C(NCCOC2=CC=C3C=CC=CC3=C2)C=C1.Cl.O.[K+].[OH-] .",
"input": "",
"output": " O=C(O)C1=CC=C(NCCOC2=CC=C3C=CC=CC3=C2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC(=O)O.CCOC(=O)C1=CC=CN=C1N1N=NN=C1C.CC[O-].CN(C)C=O.[K+] as the reactants and reagents.",
"input": "",
"output": " OC1=CC2=NN=NN2C2=NC=CC=C12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1=CNN=C1.C1CCOC1.CCCCCCCCC1=CC=C(OCC2CO2)C=C1.[Cl-].[Na+].[NaH] as the reactants and reagents.",
"input": "",
"output": " CCCCCCCCC1=CC=C(OCC(O)CN2C=CC=N2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC(C)(C)OC(=O)NCCC(=O)O.NC1=CC=CC(C2=CC=NC(NCCC3=CC=C(O)C=C3)=N2)=C1 as the reactants and reagents.",
"input": "",
"output": " NCCC(=O)NC1=CC=CC(C2=CC=NC(NCCC3=CC=C(O)C=C3)=N2)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC(C)Br.CN(C)C=O.COC1=CC(C=O)=CC=C1O.O.O=C([O-])[O-].[K+] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: COC1=CC(C=O)=CC=C1OC(C)C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(=O)CCl.CC(C)=O.O=C([O-])[O-].O=C1C=C2CCC3=CC=C(F)C=C3C2=NN1C1=CC=C(O)C=C1.[K+] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CC(=O)COC1=CC=C(N2N=C3C(=CC2=O)CCC2=CC=C(F)C=C23)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CCN(CC)CC.CCOCC.CS(C)=O.C[C@H](CO)[C@H](C)OC1CCCCO1.O as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: C[C@H](C=O)[C@H](C)OC1CCCCO1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C.COC(=O)C1=CC=C2C=C(CN3C=NC=C3C)C=CC2=C1.Cl as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CC1=CN=CN1CC1=CC=C2C=C(C(=O)O)C=CC2=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CCOC(=O)C1=C(CC)C(C2=CC=C(Cl)C=C2)=NN1C.[Al+3].[H-].[Li+] ",
"input": "",
"output": " CCC1=C(CO)N(C)N=C1C1=CC=C(Cl)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC(C)(C)[Si](C)(C)O[C@H]1CC[C@H](N)C1.CCC1=CC=C(NCC2=CN=C(Cl)N=C2Cl)C=C1.CCCCO.CCN(CC)CC ",
"input": "",
"output": " CCC1=CC=C(NCC2=CN=C(Cl)N=C2N[C@H]2CC[C@H](O[Si](C)(C)C(C)(C)C)C2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C=C(C(=O)OC)C1=CC(C(F)(F)F)=CC(C(F)(F)F)=C1.CCO.[Pd] ",
"input": "",
"output": " COC(=O)C(C)C1=CC(C(F)(F)F)=CC(C(F)(F)F)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. C=C(C)C.CC1=CC=C(S(=O)(=O)O)C=C1.CC1=CC=CC=C1.CCCCOC(=O)/C=C\\[C@H]1[C@@H](C(=O)OC(C)(C)C)C1(C)C ",
"input": "",
"output": " CCCCOC(=O)/C=C\\[C@H]1[C@@H](C(=O)O)C1(C)C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C=CC1=CC=NC=C1.CC#N.CC(=O)[O-].CC(C)(C)OC(=O)N1CCC[C@H]1COC1=CN=C(Cl)C(Br)=C1.CC1=CC=CC=C1P(C1=CC=CC=C1C)C1=CC=CC=C1C.CCN(CC)CC.O=C([O-])O.[Na+].[Pd+2] , what product could potentially be produced?",
"input": "",
"output": "The product can be CC(C)(C)OC(=O)N1CCC[C@H]1COC1=CN=C(Cl)C(C=CC2=CC=NC=C2)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CCN(CC)CC.COC1=C(N)C=C(C(C)(C)C)C=C1NC(=O)C1=CC=C(C)C(OC2=CC=NC(CC3CCN(C(=O)OC(C)(C)C)CC3)=C2)=C1.ClCCl.O.O=C(Cl)C1CC1 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: COC1=C(NC(=O)C2=CC=C(C)C(OC3=CC=NC(CC4CCN(C(=O)OC(C)(C)C)CC4)=C3)=C2)C=C(C(C)(C)C)C=C1NC(=O)C1CC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C#CCBr.C1=C[C@@H]2CCCC[C@H]2N2C3=C(CCC=C13)C1=CN=CC=C12.CCN(CC)CC.CN(C)C=O.O as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " C#CCC1CCC2C(C=CC3=CCCC4=C3N2C2=CC=NC=C42)C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC1=CC=C(S(=O)(=O)O)C=C1.CC1=CC=CC=C1.NS(=O)(=O)C1=CC=C(Cl)C=C1.O=CC1=CN=CN=C1 Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be O=S(=O)(/N=C/C1=CN=CN=C1)C1=CC=C(Cl)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC(C)(C)NC(=O)C1C2=C(CCN1C[C@@H](O)[C@H](CC1=CC=CC=C1)NC(=O)OCC1=CC=CC=C1)C1=CC=CC=C1N2.CCO.[Pd] ",
"input": "",
"output": " CC(C)(C)NC(=O)C1C2=C(CCN1C[C@@H](O)[C@@H](N)CC1=CC=CC=C1)C1=CC=CC=C1N2 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C1=CC=NC=C1.CCOC(=O)C1=CC=C(NCC2=CC=C(Cl)C=C2)C=C1.CCOC(=O)Cl.O , what product could potentially be produced?",
"input": "",
"output": "The product can be CCOC(=O)C1=CC=C(N(CC2=CC=C(Cl)C=C2)C(=O)OCC)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1=CC=C2N=C(CN3CCNCC3)C=CC2=C1.CN(C)C=O.O=C([O-])[O-].O=C1CS(=O)C2=CC(OCCCCl)=CC=C2N1.[I-].[K+] ",
"input": "",
"output": " O=C1CS(=O)C2=CC(OCCCN3CCN(CC4=CC=C5C=CC=CC5=N4)CC3)=CC=C2N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CC=C([C@H]2O[C@@H]2C2=CC=CC=C2)C=C1.CC(C)OC(C)C.CO.CSCCN Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CSCCNC(C1=CC=CC=C1)C(O)C1=CC=CC=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1COCCO1.CC1(C)OB(C2=CC=C(C#N)N=C2)OC1(C)C.CC1=CC(C(O)(C(C)C2=CC=C(Br)C=C2Cl)C(F)(F)F)=CC=N1.O.O=C([O-])[O-].[Cs+] ",
"input": "",
"output": " CC1=CC(C(O)(C(C)C2=CC=C(C3=CC=C(C#N)N=C3)C=C2Cl)C(F)(F)F)=CC=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CN(C)C1=CC=C(C=O)C=C1.CS(C)=O.O.O=C1NN=CC2=CC(C[P+](C3=CC=CC=C3)(C3=CC=CC=C3)C3=CC=CC=C3)=CC=C12.[Br-] .",
"input": "",
"output": " CN(C)C1=CC=C(/C=C\\C2=CC=C3C(=O)NN=CC3=C2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC(C)(C)OC(=O)CC(=O)C1=CC=CC(C2=CC=CN=C2)=C1.CC(C)(C)OC(=O)NC1=CC=C(C#CC2=CC=CC=C2)C=C1N ",
"input": "",
"output": " CC(C)(C)OC(=O)NC1=CC=C(C#CC2=CC=CC=C2)C=C1NC(=O)CC(=O)C1=CC=CC(C2=CC=CN=C2)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CCCCOC(=O)N1CCN(C(=O)[C@H](CCC2=NN=NN2C)NC(=O)OC(C)(C)C)CC1.ClCCl.O=C(O)C(F)(F)F as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CCCCOC(=O)N1CCN(C(=O)[C@@H](N)CCC2=NN=NN2C)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CC1=CC2=C(C=C1F)SC(C(=O)CC(=O)C(F)(F)F)=N2.CS(=O)(=O)C1=CC=C(NN)C=C1.Cl as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CC1=CC2=C(C=C1F)SC(C1=CC(C(F)(F)F)=NN1C1=CC=C(S(C)(=O)=O)C=C1)=N2 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1COCCN1.COC1=CC(F)=C(F)C=C1C1=NN=C(C2=C(C)ON=C2C2=CC=CC=C2)O1 Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be COC1=CC(N2CCOCC2)=C(F)C=C1C1=NN=C(C2=C(C)ON=C2C2=CC=CC=C2)O1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C1CSCN1.CC(C)(C)OC(=O)NC(CC1=CC=CC=C1F)C(=O)O.CN(C)C1=CC=NC=C1.ClC(Cl)Cl.ClCCCl.ClCCl .",
"input": "",
"output": " CC(C)(C)OC(=O)NC(CC1=CC=CC=C1F)C(=O)N1CCSC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C#CCBr.CC#N.CCC(C)=C1OC(=O)N(C2=CC(O)=C(Br)C=C2F)C1=O.O=C([O-])[O-].[K+] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be C#CCOC1=CC(N2C(=O)OC(=C(C)CC)C2=O)=C(F)C=C1Br .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1CCOC1.CO.Cl.N#CC1(C2=NC=CC=N2)CCC2(CC1)OCCO2.[Na+].[OH-] ",
"input": "",
"output": " O=C(O)C1(C2=NC=CC=N2)CCC2(CC1)OCCO2 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CN[C@@H](CO)[C@@H](O)CSC.CO.O=CC1=CN(COCC2=CC=CC=C2)C2=C(Cl)N=CN=C12.[BH3-]C#N.[Na+] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CSC[C@@H](O)[C@@H](CO)N(C)CC1=CN(COCC2=CC=CC=C2)C2=C(Cl)N=CN=C12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C#CC1=CC=CC=C1.N.ON=C(Cl)C1=CN=CN=C1 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " C1=CC=C(C2=CC(C3=CN=CN=C3)=NO2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. FC1=CC=C(C2CCNC2)C=C1.O=C(O)C(=O)O.O=C(O)C1=C(C2=CC=CC=C2Cl)ON=C1 ",
"input": "",
"output": " O=C(C1=C(C2=CC=CC=C2Cl)ON=C1)N1CCC(C2=CC=C(F)C=C2)C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC1=C(C)SC(N)=N1.CC1=CC=CC=C1C.Cl.N=C(C1=CC(F)=CC(C(F)(F)F)=C1)C1=CC=C(Cl)C=N1 Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CC1=C(C)SC(/N=C(\\C2=CC(F)=CC(C(F)(F)F)=C2)C2=CC=C(Cl)C=N2)=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C1=CCC=CC1.CCO.CCOC(C)=O.COC1=CC=C(C(=O)C2=CCCCC3=C2C=C(OC)C(OC)=C3OC)C(OCC2=CC=CC=C2)=C1OCC1=CC=CC=C1.[Pd] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " COC1=CC=C(C(=O)C2=CCCCC3=C2C=C(OC)C(OC)=C3OC)C(O)=C1O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CCOC(=O)CC1=CSC(C#N)=N1.CO.C[O-].[Cl-].[NH4+].[Na+] ",
"input": "",
"output": " COC(=O)CC1=CSC(C(=N)N)=N1.Cl ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC1=C(N2CCNCC2)N=C2C=C(F)C=C(F)C2=C1NC1=CN=CC(N2CCOCC2)=C1.O=CCC(F)(F)F ",
"input": "",
"output": " CC1=C(N2CCN(CCC(F)(F)F)CC2)N=C2C=C(F)C=C(F)C2=C1NC1=CN=CC(N2CCOCC2)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C1CNCCNC1.CN(C)C=O.ClCCl.FC1=CC=C(C(CCCBr)C2=CC=C(F)C=C2)C=C1.[I-].[K+] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: FC1=CC=C(C(CCCN2CCCNCC2)C2=CC=C(F)C=C2)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC(=O)O.CCO.O=C(O)C1=CC=CC=C1C(=O)NC1=CN=C2C(=C1)C(C1=CN=CS1)=CN2S(=O)(=O)C1=CC=CC=C1.[Na+].[OH-] ",
"input": "",
"output": " O=C(O)C1=CC=CC=C1C(=O)NC1=CN=C2NC=C(C3=CN=CS3)C2=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CC=NC=C1.CC(=O)Cl.COC(=O)NC1CC2=CC=CC=C2C1O.ClCCl.N[C@@H](CC1=CC=CC=C1)C(=O)O Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be COC(=O)NC1CC2=CC=CC=C2C1OC(C)=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC(C)=O.CCOC(=O)C(Cl)C(=O)OCC.O=C([O-])[O-].OC1=CC=C2C=CC=CC2=C1.[K+] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CCOC(=O)C(OC1=CC=C2C=CC=CC2=C1)C(=O)OCC ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CCOC(=O)C1=CN(CO)N=C1C(F)(F)F.ClCCl.O=S(Cl)Cl as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CCOC(=O)C1=CN(CCl)N=C1C(F)(F)F ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC(=O)O.CCOC(C)=O.CO.COCC(=O)C(C)(C)C(=O)OC.NC1=CC=CC=C1N.[BH3-]C#N.[Na+] , what product could potentially be produced?",
"input": "",
"output": "The product can be COCC(NC1=CC=CC=C1N)C(C)(C)C(=O)OC .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C=CCC1(NCC2=CC=C(OC)C=C2)CCC2(CC1)OCCO2.CC(C)=O.Cl.ClCCl.O.O=C([O-])O.[Na+] as the reactants and reagents.",
"input": "",
"output": " C=CCC1(NCC2=CC=C(OC)C=C2)CCC(=O)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(=O)C1=CC=C2C(=C1)N=C(CO)N2C.O=[Mn](=O)(=O)[O-].[K+] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CC(=O)C1=CC=C2C(=C1)N=C(C(=O)O)N2C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. C1CCOC1.C=C[Mg]Br.O.O=CC1CCCCC1.[Cl-].[NH4+] ",
"input": "",
"output": " C=CC(O)C1CCCCC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CC(C)(CC#N)OC1=CC=C(Cl)C=C1.CS(C)=O.ClCCl.O.O=C([O-])[O-].OO.[K+] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CC(C)(CC(N)=O)OC1=CC=C(Cl)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C=C1CCC(C)(COC2=CC(F)=C(C(=O)OC(C)(C)C)C=C2C2CC2)CC1.CC[Zn]CC.ClCCCl.ClCI as the reactants and reagents.",
"input": "",
"output": " CC1(COC2=CC(F)=C(C(=O)OC(C)(C)C)C=C2C2CC2)CCC2(CC1)CC2 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC#N.CC(=O)Cl.CC1=CC=CC(NC2=NC=NC3=C2C=CN3)=C1.[H-].[Na+] ",
"input": "",
"output": " CC(=O)N1C=CC2=C(NC3=CC=CC(C)=C3)N=CN=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C=CCBr.C=CCOCC=C.CC(C)(C)C1=CC(Cl)=CC=C1O.CC1=CC(C)=CC(C)=C1.O=C([O-])[O-].[K+] .",
"input": "",
"output": " C=CCC1=CC(Cl)=CC(C(C)(C)C)=C1O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CCN(CC)C1=NC2=CC(C(=O)OC)=CC=C2N=C1C1=CC=CC=C1.CO.Cl.O.[Na+].[OH-] ",
"input": "",
"output": " CCN(CC)C1=NC2=CC(C(=O)O)=CC=C2N=C1C1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CC1=CC=C(C2=C(C(=O)C3=C(Cl)N=CN=C3Cl)C=NN2C)C=C1.CCC1=CC=C(N2C=NC=C2C(O)C2=C(Cl)N=CN=C2Cl)C=C1.CCOC(C)=O as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CCC1=CC=C(N2C=NC=C2C(=O)C2=C(Cl)N=CN=C2Cl)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C=C[C@](N)(CCC(=O)OC)C(=O)OC.COCCO.Cl.O=C([O-])[O-].[Na+] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be C=CC1(C(=O)OC)CCC(=O)N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C1CCOC1.CSC(=N)NC(=O)C1=NC(Cl)=C(N)N=C1N.N[C@H]1CCCN(CC2=CC=CC=C2)C1 as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " N=C(NC(=O)C1=NC(Cl)=C(N)N=C1N)N[C@H]1CCCN(CC2=CC=CC=C2)C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. COC(=O)[C@H]1O[C@H](Br)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O.NC(=O)C1=C([O-])NC=[N+]1CC1=CC=C([N+](=O)[O-])C=C1 ",
"input": "",
"output": " COC(=O)[C@H]1O[C@@H](OC2=C(C(N)=O)N(CC3=CC=C([N+](=O)[O-])C=C3)C=N2)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CC=NC=C1.CCOC(=O)[C@@H](OC(C)(C)C)C1=C(C)C=C2N=C(C3=CC=NC(C4=CC=C5N=C(NC)C=CC5=C4)=C3)SC2=C1C1=CC=C(Cl)C=C1.[I-].[Li+] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CNC1=CC=C2C=C(C3=CC(C4=NC5=CC(C)=C([C@H](OC(C)(C)C)C(=O)O)C(C6=CC=C(Cl)C=C6)=C5S4)=CC=N3)C=CC2=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CCCCN1CC2CN(CCCC)CC(C1)C2O.O=C(Cl)C1=CC=C(Cl)C=C1 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CCCCN1CC2CN(CCCC)CC(C1)C2OC(=O)C1=CC=C(Cl)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCOC(=O)COC1=CC=CC(C(=O)OC)=C1OCC(=O)OCC.CO.[Na+].[OH-] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be O=C(O)COC1=CC=CC(C(=O)O)=C1OCC(=O)O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC(C)=O.CI.NC(=S)CC1=CC=C(Cl)C=C1 as the reactants and reagents.",
"input": "",
"output": " CSC(=N)CC1=CC=C(Cl)C=C1.I ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses COC(=O)C1=C([N+](=O)[O-])C=CC=C1S(=O)(=O)NC(C)(C)C.O=C(O)C(F)(F)F as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: COC(=O)C1=C([N+](=O)[O-])C=CC=C1S(N)(=O)=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C1CCOC1.CC(=O)O.CCOC(C)=O.ClC1=CC=C2C=CC(CCCC3=CC=CC(C4OCCO4)=C3)=NC2=C1.O as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: O=CC1=CC=CC(CCCC2=CC=C3C=CC(Cl)=CC3=N2)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) COC1=CC=C(CNC2=CN=C3C=CC(C)=CC3=N2)C(OC)=C1.ClCCl.O=C(O)C(F)(F)F as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CC1=CC=C2N=CC(N)=NC2=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1CCOC1.CCO.CN(C1=CC=CC2=C1NC(C1=NCC(C=O)S1)=C2)S(=O)(=O)C1=CC=CC=N1.[BH4-].[Cl-].[NH4+].[Na+] ",
"input": "",
"output": " CN(C1=CC=CC2=C1NC(C1=NCC(CO)S1)=C2)S(=O)(=O)C1=CC=CC=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CCOC(=O)C1=NC=C(CC2=CC=CC=C2)O1.CO.O.[Li+].[OH-] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " O=C(O)C1=NC=C(CC2=CC=CC=C2)O1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.CC#N.CCOC(=O)C1CCN(C(=O)OC(C)(C)C)CC1.[Li]CCCC Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CC(C)(C)OC(=O)N1CCC(C(=O)CC#N)CC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. Br.C1CCOC1.CCN(CC)CC.CCSC(=N)N.CNC(=O)N1C(=O)C(=O)C2=CC(Cl)=CC=C21 ",
"input": "",
"output": " CN1C(=O)NC2=CC=C(Cl)C=C2C12NC(=O)NC2=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CCOC(=O)C(Br)C(C)C.NC(=S)NC12CC3CC(CC1C3)C2 ",
"input": "",
"output": " CC(C)C1SC(NC23CC4CC(CC2C4)C3)=NC1=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(=O)Cl.CCN(C(C)C)C(C)C.NC1CCCC2=C1NC1=CC=C(Br)C=C21 Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CC(=O)NC1CCCC2=C1NC1=CC=C(Br)C=C21 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC(C)(C)NCC(O)COC1=CC=C(C(=O)O)C=C1C1=NNC(=O)C=C1.CCO.Cl ",
"input": "",
"output": " CCOC(=O)C1=CC=C(OCC(O)CNC(C)(C)C)C(C2=NNC(=O)C=C2)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. C1CCOC1.CC(C)(C)OC(=O)C1=CC=C(CCC=O)C=C1.CC(C)(C)[O-].CC1=CC=CC=C1.CCOCC.COC[P+](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1.[Cl-].[K+] ",
"input": "",
"output": " COC=CCCC1=CC=C(C(=O)OC(C)(C)C)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CCN(CC)CC.CO.COC(=O)C(O)OC.C[C@H](O)C1=CC=C2C=CC=CC2=C1.ClCCl.O=S(Cl)Cl.[N-]=[N+]=NCCCCCCC(N)=O ",
"input": "",
"output": " COC(=O)C(NC(=O)CCCCCCN=[N+]=[N-])O[C@@H](C)C1=CC=C2C=CC=CC2=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC1=C(Cl)C=CC=C1S(=O)(=O)Cl.CCC1=CSC(N)=N1 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CCC1=CSC(NS(=O)(=O)C2=CC=CC(Cl)=C2C)=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C1COCCO1.CC(C)C[C@H](NC(=O)OC(C)(C)C)C(=O)NC1CCCN(C(=O)OCC2=CC=CC=C2)CC1O.CO.Cl as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CC(C)C[C@H](N)C(=O)NC1CCCN(C(=O)OCC2=CC=CC=C2)CC1O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC1(C2=CC=CN=C2)CO1.CC1=CC=C2NC3=C(CN(C)CC3)C2=C1C.CN(C)C=O.[H-].[Na+] ",
"input": "",
"output": " CC1=CC=C2C(=C1C)C1=C(CCN(C)C1)N2CC(C)(O)C1=CC=CN=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC1(C)CCNC2=CC=CC=C21.CCN(CC)CC.ClCCl.O=S(=O)(Cl)C1=CC(Br)=C(Cl)C=C1F.O=S(=O)(Cl)Cl ",
"input": "",
"output": " CC1(C)CCN(S(=O)(=O)C2=CC(Br)=C(Cl)C=C2F)C2=CC=CC=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " COC1=CC=C(C)C=C1N.FC(F)(F)C1=CC(Cl)=NC(C2=CC=CC=N2)=N1 Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " COC1=CC=C(C)C=C1NC1=CC(C(F)(F)F)=NC(C2=CC=CC=N2)=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC(C)(C)[O-].CC(C)C1=CC(C(C)C)=C(C2=CC=CC=C2)C(C(C)C)(P(C2CCCCC2)C2CCCCC2)C1.CC1=C(C2=CC=CC=N2)N=C2C=C(F)C=C(F)C2=C1Cl.CC1=CC=CC=C1.COC1=CC=CC=C1C1=NC=CC=C1N.O=C(/C=C/C1=CC=CC=C1)/C=C/C1=CC=CC=C1.[Na+].[Pd] ",
"input": "",
"output": " COC1=CC=CC=C1C1=NC=CC=C1NC1=C(C)C(C2=CC=CC=N2)=NC2=CC(F)=CC(F)=C12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C1=CC=C(CNC2=CC(C3=CC4=NC=CN4C(N4CC5CC4CN5)=N3)=CC=N2)C=C1.CC(=O)O[BH-](OC(C)=O)OC(C)=O.CC(C)=O.ClC(Cl)Cl.ClCCl.O=C([O-])O.[Na+] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CC(C)N1C[C@@H]2C[C@H]1CN2C1=NC(C2=CC=NC(NCC3=CC=CC=C3)=C2)=CC2=NC=CN12 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C#CCN1C(=O)C=CC2=CC=CC=C21.CC1=NN=C2CN=C(C3=CC=CC=C3Cl)C3=C(SC(I)=C3)N12.CCO.ClCCl Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CC1=NN=C2CN=C(C3=CC=CC=C3Cl)C3=C(SC(C#CCN4C(=O)C=CC5=CC=CC=C54)=C3)N12 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CN[C@@H]1[C@H](O[C@H]2[C@H](O[C@H]3[C@H](O)[C@@H](O)[C@H](N=C(N)N)[C@@H](O)[C@@H]3N=C(N)N)O[C@@H](C)[C@]2(O)C=O)O[C@@H](CO)[C@H](O)[C@H]1O.O=P([O-])([O-])[O-].O=S(=O)(O)O ",
"input": "",
"output": " CN[C@@H]1[C@H](O[C@H]2[C@H](O[C@H]3[C@H](O)[C@@H](O)[C@H](NC(=N)N)[C@@H](O)[C@@H]3NC(=N)N)O[C@@H](C)[C@]2(O)C=O)O[C@@H](CO)[C@H](O)[C@H]1O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC1=CC=C([N+](=O)[O-])C(C)=C1N(C)C.CC1=CC=CC(C)=C1N(C)C.O.O=C([O-])[O-].O=S(=O)(O)O.O=[N+]([O-])O.[Na+] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CC1=CC=C(O)C(C)=C1N(C)C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if O=C1C=C(C2CC2)N=C(C2=CC=CC(Cl)=C2)N1.O=P(Cl)(Cl)Cl is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " ClC1=CC=CC(C2=NC(Cl)=CC(C3CC3)=N2)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CC(C)(C)OC(=O)N(C(=O)OC(C)(C)C)C1=NC=CC2=CC(N)=CC=C12.CC(C)(C)OC(=O)NCC1=CC=CC(NC(=O)OCCC2=CC=C(B(O)O)C=C2Cl)=C1.O.O=CC(=O)O as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CC(C)(C)OC(=O)NCC1=CC=CC(NC(=O)OCCC2=CC=C(C(NC3=CC=C4C(N(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C)=NC=CC4=C3)C(=O)O)C=C2Cl)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1=CC=CC=C1.CC(C)O.COC1=CC=C(NC2=NC(Cl)=NC(NC3CCCCCC3)=N2)C=C1Cl.[Na+].[OH-] as the reactants and reagents.",
"input": "",
"output": " COC1=CC=C(NC2=NC(NC3CCCCCC3)=NC(OC(C)C)=N2)C=C1Cl ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C1COCCO1.CC(=O)O.CSCC1=CS[C@@H]2[C@H](NC(=O)CC3=CC=CC=C3)C(=O)N2[C@H]1C(=O)O.[N-]=[N+]=C(C1=CC=CC=C1)C1=CC=CC=C1 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CSCC1=CS[C@@H]2[C@H](NC(=O)CC3=CC=CC=C3)C(=O)N2[C@H]1C(=O)OC(C1=CC=CC=C1)C1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. BrCC1=CC=CC=C1.CC1=CC(C2=C(C)C3=CC(O)=CC=C3N2)=CC(C)=C1O ",
"input": "",
"output": " CC1=CC(C2=C(C)C3=CC(OCC4=CC=CC=C4)=CC=C3N2)=CC(C)=C1O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CCOC(=O)CC1=C(C(=O)OCC)C2=CC(O)=CC=C2N1C1=CC=CC=C1.OB(O)C1=CC=C(Cl)C=C1 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CCOC(=O)CC1=C(C(=O)OCC)C2=CC(OC3=CC=C(Cl)C=C3)=CC=C2N1C1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CCO.NC(N)=S.O=C1CC2=CC(C(=O)CBr)=CC=C2N1 as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " NC1=NC(C2=CC=C3NC(=O)CC3=C2)=CS1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC(=O)CC(=O)OCCC#N.CC(C)O.COC1=CC(C#N)=CC=C1C=O.NC1=CC(=O)NC=C1 as the reactants and reagents.",
"input": "",
"output": " COC1=CC(C#N)=CC=C1C1C(C(=O)OCCC#N)=C(C)NC2=C1C(=O)NC=C2 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CC=CC=C1.CCOC(C)=O.CN(C)C=O.COC1=CC=C2C(=C1)C=C(C(=O)O)CN1C2=C(C2CCCCC2)C2=CC=C(C(=O)OC(C)(C)C)C=C21.O=C([O-])[O-].[C-]#[N+]CC(=O)OC.[K+].[N-]=[N+]=NP(=O)(C1=CC=CC=C1)C1=CC=CC=C1 Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " COC(=O)C1=C(C2=CC3=CC(OC)=CC=C3C3=C(C4CCCCC4)C4=CC=C(C(=O)OC(C)(C)C)C=C4N3C2)OC=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CCNC(=O)NOCC(=O)O.CCOC(OCC)[C@H](C)N(CC1=CSC2=CC=CC=C12)C(=O)[C@@H](N)CC1=CC=C(OC(C)(C)C)C=C1 ",
"input": "",
"output": " CCNC(=O)NOCC(=O)N[C@@H](CC1=CC=C(OC(C)(C)C)C=C1)C(=O)N(CC1=CSC2=CC=CC=C12)[C@@H](C)C(OCC)OCC ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CC(=O)SCC(C)C(=O)Cl.CC(=O)SCC(C)C(=O)N1CCC=C1C(=O)O.CC1=CC=C(C(=O)SCC(C)C(=O)Cl)C=C1 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CC1=CC=C(C(=O)SCC(C)C(=O)N2CCC=C2C(=O)O)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CCCN1C(C2=CC=CC=C2)=CC(=O)C(C(=O)O)=C1C1=CC=CC=C1.CO.[Na+].[OH-] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CCCN1C(C2=CC=CC=C2)=CC(=O)C(C(=O)[O-])=C1C1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. C1CCOC1.O.O=[N+]([O-])/C=C1/CCCC2=CC=CC=C2N1.[Al+3].[H-].[Li+] ",
"input": "",
"output": " NCC1CCCC2=CC=CC=C2N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CO.COC(=O)C1=CN(CCC2=CC=C([N+](=O)[O-])C=C2)C2=C1C(SC)=NCC2.COC(CN)OC Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be COC(=O)C1=CN(CCC2=CC=C([N+](=O)[O-])C=C2)C2=C1C(NCC(OC)OC)=NCC2 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC(=O)O[C@H](C)CCCCCl.CNC1=C(N)N(CC2=CC=CC=C2)C(=O)NC1=O.CS(C)=O.[H-].[Na+] ",
"input": "",
"output": " CNC1=C(N)N(CC2=CC=CC=C2)C(=O)N(CCCC[C@@H](C)OC(C)=O)C1=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CCO.CCOC(=O)C(CCC(=O)OC)C(=O)OCC.[N-]=[N+]=NCC1=CC=CC=C1.[NaH] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " O=C(O)CCC1=C(O)N(CC2=CC=CC=C2)N=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C1=CC=CC=C1.CCCCCC.CCOC(=O)C(C)(C)C1=NC2=C(C#N)C(C)=C(C3=CC=CC=C3)C(F)=C2O1.CCOC(C)=O.C[Al](C)C.[Cl-].[NH4+].[Na+].[OH-] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CC1=C(C2=CC=CC=C2)C(F)=C2OC(C(C)(C)C(N)=O)=NC2=C1C#N .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CCN(CC)CC.CCNC1=CC=CC=C1.CN(C)C1=CC=NC=C1.CN(C)C=O.ClCCl.O.O=C(Cl)C(=O)Cl.O=C(O)C1=CC=C([N+](=O)[O-])C=C1I ",
"input": "",
"output": " CCN(C(=O)C1=CC=C([N+](=O)[O-])C=C1I)C1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CO.N#CCC1=CC=CC=C1.O.O=[N+]([O-])C1=CC=C(Br)C=C1.[K+].[OH-] ",
"input": "",
"output": " BrC1=CC2=C(C3=CC=CC=C3)ON=C2C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C1=CN=CC(C2CCCN2)=C1.CCCCC(C(=O)O)C1OC(C)(C)OC1=O is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CCCC[C@@H](C(=O)N1CCCC1C1=CC=CN=C1)[C@H](O)C(=O)O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CO.COC(=O)C1=C(C#N)N=C(NC2CCCCC2)N=C1NC1=CC=CC(C)=C1.Cl.O=C([O-])O.[Na+].[Pd] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC1=CC=CC(NC2=NC(NC3CCCCC3)=NC3=C2C(=O)NC3)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC1=NC2=CC3=C(C=C2C(=O)N1COC(=O)C(C)(C)C)C(NC1=CC=C(C(=O)O)C(F)=C1)CC3.ClCCl.OC1=C(F)C(F)=C(F)C(F)=C1F.ON1N=NC2=CC=CC=C21 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC1=NC2=CC3=C(C=C2C(=O)N1COC(=O)C(C)(C)C)C(NC1=CC=C(C(=O)OC2=C(F)C(F)=C(F)C(F)=C2F)C(F)=C1)CC3 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CCS.CN(C)C=O.COC1=CC=CC(C(CNC2=CC=CC3=NC=CC=C23)C2(C(F)(F)F)CO2)=C1F.O=C([O-])[O-].[Cs+] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " COC1=CC=CC(C(C2=CC=C3C(N)=CC=CC3=N2)C2(C(F)(F)F)CO2)=C1F ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC(=O)OC(C)=O.NC(=O)NC1=CC=C(S(=O)(=O)OC2=CC=CC=C2)C=C1[N+](=O)[O-].O=S(=O)(O)O as the reactants and reagents.",
"input": "",
"output": " CC(=O)NC(=O)NC1=CC=C(S(=O)(=O)OC2=CC=CC=C2)C=C1[N+](=O)[O-] ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC(=O)NC1=CC=C(S(=O)(=O)Cl)C=C1.CN1C=CC=C1CCN ",
"input": "",
"output": " CC(=O)NC1=CC=C(S(=O)(=O)NCCC2=CC=CN2C)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CO.C[C@H]1CC2=CC(OC3CCCCO3)=CC=C2[C@H]2CC[C@]3(C)C(=C(F)F)CC[C@H]3[C@@H]21.O.O=C(O)C(=O)O Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " C[C@H]1CC2=CC(O)=CC=C2[C@H]2CC[C@]3(C)C(=C(F)F)CC[C@H]3[C@@H]21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC1=CC2=C(F)C(OC3=NC=NN4C=C(O)C(C)=C34)=CC=C2N1.CN(C)C=O.ClCC1CO1.O=C([O-])[O-].[K+] ",
"input": "",
"output": " CC1=CC2=C(F)C(OC3=NC=NN4C=C(OCC5CO5)C(C)=C34)=CC=C2N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C1CCOC1.CCOC=O.CON=C1CC[C@H]2C[C@@H]1C2(C)C.[Li]CCCC as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CON=C1[C@@H](C=O)C[C@H]2C[C@@H]1C2(C)C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using Cl.NC1=CC(C2=NC3=CC=CC=C3O2)=CC=C1NC1CCOCC1.O=N[O-].[Na+].[OH-] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " C1=CC=C2OC(C3=CC=C4C(=C3)N=NN4C3CCOCC3)=NC2=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: BrCC1=CC=CC=C1.CCO.CCOC(C)=O.[Na+].[S-]C1=CNN=N1 .",
"input": "",
"output": " CN1C=C(SCC2=CC=CC=C2)N=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses COC(=O)C=C(C)CCCC(C)CCCC(C)CCCC(C)C.O.O=C1O[C@H]([C@@H](O)CO)C(O)=C1O.O=S(=O)(O)O as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CC(=CC(=O)OC1=C(O)[C@@H]([C@@H](O)CO)OC1=O)CCCC(C)CCCC(C)CCCC(C)C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CO.Cl.O=C(O)/C=C/C1=CN=CN1.[Pd] .",
"input": "",
"output": " O=C(O)CCC1=CN=CN1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " COC1=CC=C(N)C=C1OC.O=C(O)C1=CC([N+](=O)[O-])=C(SC2=C(Cl)C=NC=C2Cl)S1 Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be COC1=CC=C(NC(=O)C2=CC([N+](=O)[O-])=C(SC3=C(Cl)C=NC=C3Cl)S2)C=C1OC .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC(C)(C)OC(=O)N1CCCC1C1=CC(N)=C(N)C=C1OC1=CC=C(S(C)(=O)=O)C=C1.CCOC(C)=O.CN(C)C=O.O=CC1=NNC=C1 ",
"input": "",
"output": " CC(C)(C)OC(=O)N1CCCC1C1=CC2=C(C=C1OC1=CC=C(S(C)(=O)=O)C=C1)N=C(C1=NNC=C1)N2 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C[C@H](N)C(=O)O.C[C@H](NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@@H](CCCCNC(=O)OC(C)(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](CO)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)OC(C)(C)C.Cl.NCC(=O)O.NCCCC[C@H](N)C(=O)O.N[C@@H](CC(=O)O)C(=O)O.N[C@@H](CCC(=O)O)C(=O)O.O.O=C(O)C(F)(F)F Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be C[C@H](NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](CO)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CC=C([PH](C2=CC=CC=C2)(C2=CC=CC=C2)[Pd]([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)[PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.CC1=CN(C)N=C1C(=O)NC1=CC([Sn](C)(C)C)=CC2=C1C=NN2S(=O)(=O)C1=CC=CC=C1.CN(C)C=O.N#CC1=CC(Br)=C2C=CN(S(=O)(=O)C3=CC=C([N+](=O)[O-])C=C3)C2=C1 Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CC1=CN(C)N=C1C(=O)NC1=CC(C2=CC(C#N)=CC3=C2C=CN3)=CC2=C1C=NN2 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CN(C)C=O.CO.O.O=[N+]([O-])C1=C(F)C(Cl)=CC2=C1NC1=CN=CC=C12.[H-].[Na+] ",
"input": "",
"output": " COC1=C(Cl)C=C2C(=C1[N+](=O)[O-])NC1=CN=CC=C12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CN(C)C=O.CO.COC1=NC(Br)=CN=C1N(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C.C[C@H](O)CNC1=NC=CC(C2=CN(CC(F)F)N=C2[Sn](C)(C)C)=N1.I[Cu]I.O as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " COC1=NC(C2=NN(CC(F)F)C=C2C2=CC=NC(NC[C@H](C)O)=N2)=CN=C1N ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC1=CC(Br)=CC=C1OCCN1CCCC1.CC1=CC(CC2=C(C3=CC=C(OCCC4CCCN4)N=C3)SC3=CC(O)=CC=C23)=CC=C1CN1CCCC1.O=C(O)C(=O)O ",
"input": "",
"output": " CC1=CC(CC2=C(C3=CC=C(OCCN4CCCC4)C(C)=C3)SC3=CC(O)=CC=C23)=CC=C1CN1CCCC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1COCCO1.CC(C)N(C)[C@@H]1CC[C@H](N2CC[C@H](NC(=O)OCC3=CC=CC=C3)C2=O)[C@H](C(=O)O)C1.CN1CCOCC1.C[Si](C)(C)CCO.[N-]=[N+]=NP(=O)(C1=CC=CC=C1)C1=CC=CC=C1 as the reactants and reagents.",
"input": "",
"output": " CC(C)N(C)[C@@H]1CC[C@H](N2CC[C@H](NC(=O)OCC3=CC=CC=C3)C2=O)[C@H](NC(=O)OCC[Si](C)(C)C)C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CCCO[C@@H]1CN(C2=NC(C(=O)O)=C(C(=O)OCC)S2)CC[C@@H]1NC(=O)C1=NC(Cl)=C(CC)N1.CCN=C=NCCCN(C)C.CN.Cl.ON1N=NC2=CC=CC=C21 ",
"input": "",
"output": " CCCO[C@@H]1CN(C2=NC(C(=O)NC)=C(C(=O)OCC)S2)CC[C@@H]1NC(=O)C1=NC(Cl)=C(CC)N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2C3=C[C@H]4O[C@]45C[C@@H](O)CC[C@]5(C)[C@H]3CC[C@]12C.[KH] ",
"input": "",
"output": " CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2C3=CC[C@]4(O)C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1CCOC1.COCC1(O)C=CC(F)=CC1F.C[Si](C)(C)Cl.[Li]CCCC ",
"input": "",
"output": " COCC1(O)C=CC(F)=C([Si](C)(C)C)C1F ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CS(C)=O.O=C(OCC1=CC=CC=C1)C1=CC=C(OC2=NC(F)=C(F)C(F)=C2F)C=C1.O=C([O-])O.O=C([O-])[O-].O=[N+]([O-])C1=C(F)C(F)=C(O)C(F)=C1F.[K+] ",
"input": "",
"output": " O=C(OCC1=CC=CC=C1)C1=CC=C(OC2=NC(F)=C(F)C(OC3=C(F)C(O)=C([N+](=O)[O-])C(F)=C3F)=C2F)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CN(C)C=O.CNCCC1=CC(OC)=CC(OC)=C1.N#CCCCBr.O.O=C([O-])[O-].[K+] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be COC1=CC(CCN(C)CCCCN)=CC(OC)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C1=CCCCC1.CC#N.O.O=[N+]([O-])[O-].[Ce].[NH4+] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CC(=O)NC1C=CCCC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CCO.CCOC1=CC(OC)=CC=C1C#N.Cl as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CCOC(=N)C1=CC=C(OC)C=C1OCC .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1CCOC1.COC1=CC(C)=C(C(=O)C2=C(Cl)C=CC(Cl)=C2C)C(OC)=C1OC.O=C([O-])O.[Al+3].[H-].[Li+].[Na+] ",
"input": "",
"output": " COC1=CC(C)=C(C(O)C2=C(Cl)C=CC(Cl)=C2C)C(OC)=C1OC ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: ClCCCN1CCNCC1.ClCCN1CCOCC1.O=C1NC2=NC=NN2C2=C1C=NC1=C2C=NN1 , what product could potentially be produced?",
"input": "",
"output": "The product can be O=C1C2=CN=C3NN=CC3=C2N2N=CN=C2N1CCCN1CCNCC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC(C)(C)[Si](C)(C)OC1=CC=C(C2=CC=C(Br)C=C2)C=C1.CCCCC[Si]1(C2=CC=CC=C2)CCC(=O)CC1.FC(F)C(F)(F)CBr .",
"input": "",
"output": " CCCCC[Si@H]1CC[C@H](C2=CC=C(C3=CC=C(OCC(F)(F)C(F)F)C=C3)C=C2)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if COC(=O)C1=CC=C2CC(CNC(=O)OC(C)(C)C)CCC2=C1.Cl.O=S(=O)(C1=CC=C2C=C(Cl)C=CC2=C1)N1CCNCC1 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC(C)(C)OC(=O)NCC1CCC2=CC(C(=O)N3CCN(S(=O)(=O)C4=CC=C5C=C(Cl)C=CC5=C4)CC3)=CC=C2C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " FC1=CC=C(I)C=C1.O=C1C=C(N2CCOCC2)N=C2N[C@H](C(F)(F)F)CCN21 Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be O=C1C=C(N2CCOCC2)N=C2N(C3=CC=C(F)C=C3)[C@H](C(F)(F)F)CCN21 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC1(C)OB(C2=CC(F)=C(O)C(Cl)=C2)OC1(C)C.CN1CCN(C2CCN(C3=C4C=C(Br)C=CC4=NC=C3C(=O)C3CC3)CC2)CC1 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CN1CCN(C2CCN(C3=C4C=C(C5=CC(F)=C(O)C(Cl)=C5)C=CC4=NC=C3C(=O)C3CC3)CC2)CC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C(=NC1CCCCC1)=NC1CCCCC1.C1COCCO1.CCOC(=O)CCCN(CC(=O)OC(C)(C)C)C(=O)[C@H]1CCCCN1C(=O)OCC1=CC=CC=C1.CN(C)C1=CC=CC=N1.ClCCl.O.OCC1=CC=CC=C1.[Li+].[OH-] ",
"input": "",
"output": " CC(C)(C)OC(=O)CN(CCCC(=O)OCC1=CC=CC=C1)C(=O)[C@H]1CCCCN1C(=O)OCC1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CO.COCOC1=C(C(OC)OC)C=C(I)C2=C1C(O)N(C(C)(C)C1=CC=CC=C1)C2=O.Cl Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be COC1C2=C(O)C(C=O)=CC(I)=C2C(=O)N1C(C)(C)C1=CC=CC=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C1COCCO1.C=CCCCN(C1=CC2=NN(C3=CC=C(Cl)C=C3)C(C(=O)NC)=C2C=C1C1CC1)S(C)(=O)=O.CC(=O)O.O.O=C1CCC(=O)N1Br.[Na+].[OH-] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CNC(=O)C1=C2C=C(C3CC3)C(N(CCCC3CO3)S(C)(=O)=O)=CC2=NN1C1=CC=C(Cl)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CCOC(=O)CP(=O)(OCC)OCC.COCCOC.O.O=CC1=CC=C(C(F)(F)F)C=C1.[H-].[H][H].[Na+] ",
"input": "",
"output": " CCOC(=O)CCC1=CC=C(C(F)(F)F)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.CO.COC(=O)C1=CC=C([N+](=O)[O-])C(NCCN2CCCC2)=C1.[Ni] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be COC(=O)C1=CC=C(N)C(NCCN2CCCC2)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCO[C@H](C)COCC1=CC=C([C@H]2C[C@H](CC(C)(C)C(=O)O)N(S(=O)(=O)C3=CC=C(C)C=C3)C[C@@H]2OCC2=CC=C3OCCN(CCCOC)C3=C2)C=C1.CN Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CCO[C@H](C)COCC1=CC=C([C@H]2C[C@H](CC(C)(C)C(=O)NC)NC[C@@H]2OCC2=CC=C3OCCN(CCCOC)C3=C2)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC(C)(C)OC(=O)N1CCC(COCC2=CC(C(F)(F)F)=CC3=C(C4CC4)N(COCC[Si](C)(C)C)N=C23)(C2=CC=CC=C2)CC1.ClCCl.O=C(O)C(F)(F)F ",
"input": "",
"output": " FC(F)(F)C1=CC(COCC2(C3=CC=CC=C3)CCNCC2)=C2NN=C(C3CC3)C2=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(=O)O.CC[C@H](C)[C@H](N)C(=O)OC(C)(C)C.CO.Cl.O=CCN1C(=O)C2=CC=CC=C2C1=O.[BH3-]C#N.[Na+] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CC[C@H](C)[C@H](NCCN1C(=O)C2=CC=CC=C2C1=O)C(=O)OC(C)(C)C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC#N.CCN(CC)CC.COC1=C2CCC(CCO)CCC2=C(OC)C(OC)=C1OC.CS(=O)(=O)Cl.O=C([O-])O.[Na+] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " COC1=C2CCC(CCOS(C)(=O)=O)CCC2=C(OC)C(OC)=C1OC ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if NC1=CC=C(F)C=C1S(=O)(=O)O.O=C(Cl)OCC1C2=CC=CC=C2C2=CC=CC=C21 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " O=C(NC1=CC=C(F)C=C1S(=O)(=O)O)OCC1C2=CC=CC=C2C2=CC=CC=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " COC(=O)N1CC[C@H]2[C@@H]1CCC[C@]2(O)C#CC1=CC=CC(C)=C1.O=C(O)CCC(=O)N1CCCC1 Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be COC(=O)N1CC[C@@H]2[C@H]1CCC[C@]2(C#CC1=CC=CC(C)=C1)OC(=O)CCC(=O)N1CCCC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC#CC(=O)O.CC1=CC(C(=O)NC2=CC=CC=N2)=CC=C1C1=C2C(N)=NC=CN2C([C@@H]2CCCCN2)=N1 ",
"input": "",
"output": " CC#CC(=O)N1CCCC[C@H]1C1=NC(C2=CC=C(C(=O)NC3=CC=CC=N3)C=C2C)=C2C(N)=NC=CN12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC1=CC=CC=C1.NCC1(O)CCC(COCC2=CC=CC=C2)CC1.O.O=C(Cl)Cl.[K+].[OH-] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be O=C1NCC2(CCC(COCC3=CC=CC=C3)CC2)O1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC(=O)O.CCCCCCCCCCCCC1=CC=C2C(Cl)=CC=CC2=C1O.ClCCl.O.O=S(=O)(O)O.OO .",
"input": "",
"output": " CCCCCCCCCCCCC1=CC(=O)C2=C(Cl)C=CC=C2C1=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C#CCNC1=CC(C(=O)OCC)=CC(S(N)(=O)=O)=C1OC1=CC=CC=C1.C=CCNC1=CC(C(=O)OCC)=CC(S(N)(=O)=O)=C1OC1=CC=CC=C1 Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be C#CCNC1=CC(C(=O)O)=CC(S(N)(=O)=O)=C1OC1=CC=CC=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CCO.C[O-].Cl.N#CCC(=O)C1=CC=C(CO)O1.NNCC1=CC=CC=C1.O.[Na+] ",
"input": "",
"output": " NC1=CC(C2=CC=C(CO)O2)=NN1CC1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.CC#N.CCOC(=O)C1=CC(N)=CC=C1C.CN1CCNCC1.O=C(Cl)C1=CC=C(CCl)C(C(F)(F)F)=C1.O=C([O-])[O-].[K+] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CCOC(=O)C1=CC(NC(=O)C2=CC=C(CN3CCN(C)CC3)C(C(F)(F)F)=C2)=CC=C1C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CCCCC1=C(CC2=CC=C(C3=CC=CC=C3C#N)C=C2)C(=O)NC(C)=N1.CCOC(C)=O.CN(C)C=O.ClCC1=CC=C(Cl)S1.[H-].[Na+] ",
"input": "",
"output": " CCCCC1=C(CC2=CC=C(C3=CC=CC=C3C#N)C=C2)C(=O)N(CC2=CC=C(Cl)S2)C(C)=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC(C)(C)OC(=O)N1CCC(O)(CN2C=C(B3OC(C)(C)C(C)(C)O3)C=N2)CC1.CC(OC1=CC(I)=CN=C1N)C1=C(Cl)C=CC(F)=C1Cl.COCCOC.O=C([O-])[O-].[Na+] ",
"input": "",
"output": " CC(OC1=CC(C2=CN(CC3(O)CCN(C(=O)OC(C)(C)C)CC3)N=C2)=CN=C1N)C1=C(Cl)C=CC(F)=C1Cl ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C1CCOC1.CC(C)O.CC1=NC(Cl)=CC(Cl)=C1C(=O)OC(C)C.[Cu]I.[H-].[Na+] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CC1=NC(Cl)=CC(OC(C)C)=C1C(=O)OC(C)C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses COC1=CC=CC=C1COCCCOC1=CC=C(C2CCN(C(=O)OC(C)(C)C)CC2O)C=C1.COCCCN1N=CC2=CC=C(CCl)C=C21 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: COCCCN1N=CC2=CC=C(COC3CN(C(=O)OC(C)(C)C)CCC3C3=CC=C(OCCCOCC4=CC=CC=C4OC)C=C3)C=C21 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC(C)(C)N.CC1=C(C2=CC=CC=C2)C2=CC3=C(C=C2C1[Si](C)(C)Cl)CCC3.CCCCCC.CCN(CC)CC ",
"input": "",
"output": " CC1=C(C2=CC=CC=C2)C2=CC3=C(C=C2C1[Si](C)(C)NC(C)(C)C)CCC3 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC1=CC=CC(N)=C1C.O=C(O)CC1=CC=CC=C1Br as the reactants and reagents.",
"input": "",
"output": " CC1=CC=CC(NC2=CC=CC=C2CC(=O)O)=C1C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC(C)(C)[O-].CCOC(=O)CC1=NC=CC(C2=CC=C(Cl)S2)=C1C(=O)OCC.CN(C)C=O.COC1=CC(OC)=NC(S(C)(=O)=O)=N1.O.[K+] , what product could potentially be produced?",
"input": "",
"output": "The product can be CCOC(=O)C1=C(C2=CC=C(Cl)S2)C=CN=C1C(C(=O)OCC)C1=CC(OC)=CC(OC)=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC[C@](C)(N)C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CC1=CN(C2=CC=C([N+](=O)[O-])C=C2[N+](=O)[O-])C=N1)C(=O)O.SC1=CC=CC=C1.[NH-][C@@H](CC1CCCCC1)C(O)CC1=CC=CC=N1 ",
"input": "",
"output": " CC[C@](C)(N)C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CC1=CNC=N1)C(=O)O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(=O)C1=CC([N+](=O)[O-])=C(Cl)S1.SC1=CC=C2C=CC=CC2=C1 Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CC(=O)C1=CC([N+](=O)[O-])=C(SC2=CC=C3C=CC=CC3=C2)S1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CCO.NN.O.O=C1C(C2=CC=C(Br)C=C2)=COC2=CC(O)=CC=C12 .",
"input": "",
"output": " OC1=CC=C(C2=NNC=C2C2=CC=C(Br)C=C2)C(O)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if COC(=O)C1=CN=CC(Br)=C1.O=[N+]([O-])C1=CC=CC(B(O)O)=C1 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " COC(=O)C1=CN=CC(C2=CC=CC([N+](=O)[O-])=C2)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC(C)(C)OC(=O)NC1=CC=CC(N)=C1.CN(C)C=O.CS(=O)(=O)OCCSC1=CC=CC(NC2=NC(Cl)=NC=C2Cl)=C1.O=C([O-])[O-].[K+] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC(C)(C)OC(=O)NC1=CC=CC(NCCSC2=CC=CC(NC3=NC(Cl)=NC=C3Cl)=C2)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC(C)C(=O)NC1=CC=CC(C2CCN(CC3=CC=C4NC=CC4=C3)CC2)=C1.COC(=O)C1=CC=CC=C1I ",
"input": "",
"output": " COC(=O)C1=CC=CC=C1N1C=CC2=CC(CN3CCC(C4=CC=CC(NC(=O)C(C)C)=C4)CC3)=CC=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC(C)(C)O.CC1=CC=CC=C1.CCN(CC)CC.COC1=CC(OC)=C(F)C(C(=O)O)=C1F.[N-]=[N+]=NP(=O)(C1=CC=CC=C1)C1=CC=CC=C1 ",
"input": "",
"output": " COC1=CC(OC)=C(F)C(NC(=O)OC(C)(C)C)=C1F ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1=CC=NC=C1.CC1=CC=C(N)C(O)=C1.CCOC(=S)[S-].Cl.[K+] ",
"input": "",
"output": " CC1=CC=C2NC(=S)OC2=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC(=O)N[C@@H]1C(O)O[C@H](CO)[C@@H](O)[C@@H]1O.N[C@H]1C(O)O[C@H](CO)[C@@H](O)[C@@H]1O.O=C[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO.OC[C@H]1O[C@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](O)O[C@@H]2CO)[C@H](O)[C@@H](O)[C@@H]1O ",
"input": "",
"output": " OC[C@H]1O[C@H](O[C@H]2[C@H](O)[C@@H](O)[C@@H](O[C@H]3[C@H](O)[C@@H](O)[C@@H](O)O[C@@H]3CO)O[C@@H]2CO)[C@H](O)[C@@H](O)[C@@H]1O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC(C)(C)OC(=O)NCC1(C2=CC=CC(C3=CC=NC4=C3C(C(F)(F)F)=NN4C(C3=CC=CC=C3)(C3=CC=CC=C3)C3=CC=CC=C3)=C2)COC1.CC[SiH](CC)CC.ClCCl.O=C(O)C(F)(F)F ",
"input": "",
"output": " NCC1(C2=CC=CC(C3=CC=NC4=C3C(C(F)(F)F)=NN4)=C2)COC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC1=CC=CC=C1N.ClC1=CC=C(Cl)C(Cl)=C1.O=C(OC1=CC=CC=C1)C1=CC=CC=C1O.OC1=CC=CC=C1 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC1=CC=CC=C1NC(=O)C1=CC=CC=C1O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C1COCCO1.COC(=O)C1=CC=CC2=C1CCN(CC1=CC=C([C@H](C)NC(=O)OC(C)(C)C)C=C1)C2.Cl.O=C([O-])O.[Na+] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: COC(=O)C1=CC=CC2=C1CCN(CC1=CC=C([C@H](C)N)C=C1)C2 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CCCCCCCCCCCCCCCCCCC(CCCCCCCCCCCCCCCCCC)CC1=CC(OC)=CC=C1OC.N.[NaH] as the reactants and reagents.",
"input": "",
"output": " CCCCCCCCCCCCCCCCCCC(CCCCCCCCCCCCCCCCCC)CC1CC(=O)CCC1=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C#C[Si](C)(C)C.CCN(CC)CC.CCOC(=O)NC1=C(I)C=CC=C1OC(F)(F)F.Cl[Pd](Cl)([PH](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1)[PH](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1.[Cu]I Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CCOC(=O)NC1=C(C#C[Si](C)(C)C)C=CC=C1OC(F)(F)F .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC(C)(C)OC(=O)CC(=O)C1=CC=CC(C2=CC=NC(COC3CCCCO3)=C2)=C1.CCOC1=CC(NC(=O)OC(C)(C)C)=C(N)C=C1C(F)(F)F is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CCOC1=CC(NC(=O)OC(C)(C)C)=C(NC(=O)CC(=O)C2=CC=CC(C3=CC=NC(COC4CCCCO4)=C3)=C2)C=C1C(F)(F)F ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1CCOC1.COC1=CC(C)=C(S(=O)(=O)N2CC3=CC=CC=C3CC2COCC(=O)[O-])C(C)=C1.O.[Na+].[OH-] ",
"input": "",
"output": " COC1=CC(C)=C(S(=O)(=O)N2CC3=CC=CC=C3C[C@H]2COCC(=O)O)C(C)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCOC(C)=O.CN(C)C=O.COC(=O)C1=NC=CN=C1Cl.O=C([O-])[O-].O=S(=O)(CC1=CC=C(Cl)C=C1Cl)NCCF.[K+] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CC(C)C(=O)OC1=C(C2=CC=C(Cl)C=C2Cl)S(=O)(=O)N(CCF)C2=NC=CN=C12 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC#N.COC1=NN2C=C(C3=CC=C(C)C(N)=C3)N=C2C=C1.FC1=CC=C(CBr)C=C1.O=C([O-])[O-].[K+] .",
"input": "",
"output": " COC1=NN2C=C(C3=CC=C(C)C(NCC4=CC=C(F)C=C4)=C3)N=C2C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CC=NC=C1.CC1=CC=CC=C1S(=O)(=O)Cl.CO.ON=C1CO[C@H]2[C@@H]1OC[C@H]2OC1=NC2=NC(C3=CC=C(C4=CC=CC=C4)C=C3)=C(Cl)C=C2N1 Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be O=C1CO[C@@H]2[C@H](OC3=NC4=NC(C5=CC=C(C6=CC=CC=C6)C=C5)=C(Cl)C=C4N3)CO[C@@H]2N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1CCOC1.CCN1C(=O)CC(C)(C)C2=CC(C)=C(C3=CC(C=O)=CC=C3OCC(F)(F)F)C=C21.CN1CCCN(C)C1=O.COP(=O)(CC(=O)OC(C)(C)C)OC.[Li]CCCC ",
"input": "",
"output": " CCN1C(=O)CC(C)(C)C2=CC(C)=C(C3=CC(C=CC(=O)OC(C)(C)C)=CC=C3OCC(F)(F)F)C=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CS(C)=O.NC1=C(F)C(F)=C(F)C2=C1C(=O)C(C(=O)O)=CN2C1CC1.NCCNC1=CC=CC=N1 , what product could potentially be produced?",
"input": "",
"output": "The product can be NC1=C(F)C(NCCNC2=CC=CC=N2)=C(F)C2=C1C(=O)C(C(=O)O)=CN2C1CC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1CCOC1.CCOC(=O)CBr.OCCCCCCC(F)(F)C(F)(F)F.[H-].[Na+] ",
"input": "",
"output": " O=C(O)COCCCCCCC(F)(F)C(F)(F)F ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses BrC1=CN=CN=C1.CCCCN(CCCC)CCCC.CCCO.CCOC(C)=O.CN(C)C=O.Cl[Pd](Cl)([PH](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1)[PH](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: COC(=O)N1C=CC=NC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. C1CCOC1.COC1=NC=C(C2=C(C)C=C(C(=O)NN)C=C2C)C=C1C1=CN=C(N2CC(F)C2)N=C1CN1C(=O)O[C@H](C2=CC(C(F)(F)F)=CC(C(F)(F)F)=C2)[C@@H]1C.O=C(N1C=CN=C1)N1C=CN=C1 ",
"input": "",
"output": " COC1=NC=C(C2=C(C)C=C(C3=NNC(=O)O3)C=C2C)C=C1C1=CN=C(N2CC(F)C2)N=C1CN1C(=O)O[C@H](C2=CC(C(F)(F)F)=CC(C(F)(F)F)=C2)[C@@H]1C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C1=CC=C(P(C2=CC=CC=C2)C2=CC=C3C=CC=CC3=C2C2=C3C=CC=CC3=CC=C2P(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.C1COCCO1.CC1CCCN1C1=CC=CC(N)=N1.COC(=O)C1=CC=C(C2=NN3C=CN=C3C(Br)=C2)C=C1.O=C(/C=C/C1=CC=CC=C1)/C=C/C1=CC=CC=C1.O=C([O-])[O-].[Cs+].[Pd] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: COC(=O)C1=CC=C(C2=NN3C=CN=C3C(NC3=CC=CC(N4CCCC4C)=N3)=C2)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C#CC1=C(C(C)C)C=C(C2=CC=CC=C2)N=C1C1=CC=C(F)C=C1.CC(C)(C#N)N=NC(C)(C)C#N.CCCC[SnH](CCCC)CCCC.CCOCC.II is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC(C)C1=CC(C2=CC=CC=C2)=NC(C2=CC=C(F)C=C2)=C1/C=C/I ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC(C)(C)OC(=O)C1CN(CC2=CC=C(/C(N)=N/O)C=C2)C1.CN(C)C=O.ClCCCl.O=C(O)C1=NOC(C2=CC=CC=C2)=C1C1=CC=CC=C1.ON1N=NC2=CC=CC=C21 ",
"input": "",
"output": " CC(C)(C)OC(=O)C1CN(CC2=CC=C(C3=NOC(C4=NOC(C5=CC=CC=C5)=C4C4=CC=CC=C4)=N3)C=C2)C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.CCN(C(C)C)C(C)C.CCOC(C)=O.CN(C)C(ON1N=NC2=CC=CC=C21)=[N+](C)C.CN(C)C=O.Cl.F[B-](F)(F)F.N#CC1=CC=C(C2=CC(C(=O)O)=CN=C2OCC(F)(F)F)C=C1.NN1CCC(O)CC1 Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be N#CC1=CC=C(C2=CC(C(=O)NN3CCC(O)CC3)=CN=C2OCC(F)(F)F)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C1CCOC1.CC(C)(C)OC(=O)N1CCC2(CCCNC2)CC1.CCN(C(C)C)C(C)C.O=C1C=C(Br)CO1 .",
"input": "",
"output": " CC(C)(C)OC(=O)N1CCC2(CCCN(C3=CC(=O)OC3)C2)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1CCOC1.CN(C)CCN.CN(C)CCNC(=O)N1CCN(C2=CC=C(F)C=C2)CC1.COC1=CC=C(N2CCNCC2)C=C1.O=C(N1C=CN=C1)N1C=CN=C1 ",
"input": "",
"output": " COC1=CC=C(N2CCN(C(=O)NCCN(C)C)CC2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1CCOC1.CC(C)N1C=CN(C(C)C)C1=[Pd-2](Cl)C1=NC=CC=C1Cl.CCOC(=O)[C@H]1CC[C@H](C2=NC(C)=C(Br)S2)CC1.CN1CCN(C)C1=O.C[Zn+].[Cl-] as the reactants and reagents.",
"input": "",
"output": " CCOC(=O)[C@H]1CC[C@H](C2=NC(C)=C(C)S2)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C=O.CC(C)(C)OOC(C)(C)C.CCCOC1=CC=C(C)C=C1.CCO Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CCCOC1=CC=C(CC(=O)OCC)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CCO.CCOC(C)=O.CCOC1=CC(C#N)=C(C#N)C(F)=C1OCC.CO.O=[Pt] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CCOC1=CC2=C(C(N)=NC2)C(F)=C1OCC ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1COCCO1.CC1=CC=C(S(=O)(=O)N2C(I)=C3CN(C)C4=CC=C(F)C=C4C4=C3C2=NC=C4)C=C1.O.[Na+].[OH-] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CN1CC2=C(I)NC3=NC=CC(=C23)C2=CC(F)=CC=C21 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC(C)C1=CC=CC(C(C)C)=C1N=C=O.CCC1=CC=C(NCC2=CC=C(C(=O)N(C)C)C=C2)C=C1 ",
"input": "",
"output": " CCC1=CC=C(N(CC2=CC=C(C(=O)N(C)C)C=C2)C(=O)NC2=C(C(C)C)C=CC=C2C(C)C)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C#CCC(C)C.C1CCOC1.C1CO1.C[Mg]Br.[Cl-].[NH4+] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CC(C)CC#CCCO ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1=CC=C(P(C2=CC=CC=C2)C2=CC=C3C=CC=CC3=C2C2=C3C=CC=CC3=CC=C2P(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.CC(C)(C)OC(=O)N1CCO[C@@H](C2=CC=C(Br)C=C2)C1.CC(C)(C)[O-].CC1=CC=CC=C1.N=C(C1=CC=CC=C1)C1=CC=CC=C1.O=C(/C=C/C1=CC=CC=C1)/C=C/C1=CC=CC=C1.[Na+].[Pd] ",
"input": "",
"output": " CC(C)(C)OC(=O)N1CCO[C@@H](C2=CC=C(N=C(C3=CC=CC=C3)C3=CC=CC=C3)C=C2)C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. C1=CC=C(P(C2=CC=CC=C2)C2=CC=C3C=CC=CC3=C2C2=C3C=CC=CC3=CC=C2P(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.CC(C)(C)OC(=O)N1CCO[C@H](C2=CC=C(Br)C=C2)C1.CC(C)(C)[O-].CC1=CC=CC=C1.N=C(C1=CC=CC=C1)C1=CC=CC=C1.O=C(/C=C/C1=CC=CC=C1)/C=C/C1=CC=CC=C1.[Na+].[Pd] ",
"input": "",
"output": " CC(C)(C)OC(=O)N1CCO[C@H](C2=CC=C(N=C(C3=CC=CC=C3)C3=CC=CC=C3)C=C2)C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CCCC(C)CO.CS(=O)(=O)Cl , what product could potentially be produced?",
"input": "",
"output": "The product can be CCCC(C)COS(C)(=O)=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C1CCOC1.CCCNC(=O)C1=CC=C(NC(=O)N2CC3=CC=C(C#N)C=C3C2)C=C1.CO.N.O.[Ni] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CCCNC(=O)C1=CC=C(NC(=O)N2CC3=CC=C(CN)C=C3C2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CN(C)C1=CC=C(C(=O)NC2=CC=C([N+](=O)[O-])C([N+](=O)[O-])=C2)C=C1.O=CC1=CC=C(OCCO)C=C1 Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CN(C)C1=CC=C(C(=O)NC2=CC=C3NC(C4=CC=C(OCCO)C=C4)=NC3=C2)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC1=CC=C(S(=O)(=O)OCCC2=C(C)OC(C3=CC=C(Cl)N=C3)=N2)C=C1.CCOC(C)=O.CN(C)C=O.COC(=O)CCC1=CC=C(O)C=C1C.O=C([O-])[O-].[Cs+] , what product could potentially be produced?",
"input": "",
"output": "The product can be COC(=O)CCC1=CC=C(OCCC2=C(C)OC(C3=CC=C(Cl)N=C3)=N2)C=C1C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC(N)NC(=O)OC(C)(C)C.CC1=CC=CC=C1.O=CC1=CC=CN=C1 .",
"input": "",
"output": " CC(NCC1=CC=CN=C1)NC(=O)OC(C)(C)C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC1=CC(C(=O)C2=CC(Cl)=NC=N2)=CC2=C1N(COCC[Si](C)(C)C)N=C2.CN(C)C=O.COC1=CC=C2NC(=O)N(C3CCNCC3)CCC2=C1 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: COC1=CC=C2NC(=O)N(C3CCN(C4=CC(C(=O)C5=CC(C)=C6C(=C5)C=NN6COCC[Si](C)(C)C)=NC=N4)CC3)CCC2=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC1=CC(=O)C(C(=O)O)=NN1C1=CC=C(I)C=C1.CO.ClC(Cl)Cl.O.O=S(Cl)Cl is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " COC(=O)C1=NN(C2=CC=C(I)C=C2)C(C)=CC1=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CN1COC2=C3C(=CC(F)=C2N2CC[C@@H](NC4=NC=CS4)C2)C(=O)C(C(=O)O)=CN31.O=C(OC(=O)C(F)(F)F)C(F)(F)F .",
"input": "",
"output": " CC(=O)N(C1=NC=CS1)[C@@H]1CCN(C2=C(F)C=C3C(=O)C(C(=O)O)=CN4C3=C2OCN4C)C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC(=O)O.CCOC(OCC)C1=C(C(=O)OC)NC=N1.O ",
"input": "",
"output": " COC(=O)C1=C(C=O)N=CN1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C1CCOC1.CC(C)C[Al+]CC(C)C.CCOC(=O)C=CC1=CC=CC(C(=O)C(C(=O)C2=CC(F)=CC(F)=C2)=C2NC3=CC=CC=C3N2)=C1.[H-] , what product could potentially be produced?",
"input": "",
"output": "The product can be O=C(C(C(=O)C1=CC=CC(C=CCO)=C1)=C1NC2=CC=CC=C2N1)C1=CC(F)=CC(F)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC(=O)NCCC1=CNC2=CC=C(C)C=C12.O=C1C=C(O)C(C2=CC=CC=C2)C1.O=CC1=CC=CC=C1 , what product could potentially be produced?",
"input": "",
"output": "The product can be CC(=O)NCCC1=C(C(C2=C(O)C(C3=CC=CC=C3)CC2=O)C2=CC=CC=C2)NC2=CC=C(C)C=C12 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CCN(CC1=CC=C(OC)C=C1)C1=NC(NC2=CC=C3C(=C2)C(C#N)=CN3C2CCN(C(=O)OC(C)(C)C)CC2)=NN2C(C#N)=CN=C12.COC1=CC=CC=C1.ClCCCl.O=C(O)C(F)(F)F as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CCNC1=NC(NC2=CC=C3C(=C2)C(C#N)=CN3C2CCN(C[C@H](C)O)CC2)=NN2C(C#N)=CN=C12 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC(CCl)CC1=CC=CC=C1.CCCCC(C)(C)Cl.ClC(Cl)Cl .",
"input": "",
"output": " CCCCC(C)(C)C1=CC=C(CC(C)CCl)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CCN(CC)CC.CN(C)C=O.Cl.NC1=CC=C2SC(C(=O)N[C@H]3CN4CCC3CC4)=CC2=C1.O=C(Cl)C1=CC=CC=C1 .",
"input": "",
"output": " O=C(NC1=CC=C2SC(C(=O)N[C@H]3CN4CCC3CC4)=CC2=C1)C1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CO.CON=C1C(=O)NC2=CC=CC=C2NC1=O.[Pd] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " NC1C(=O)NC2=CC=CC=C2NC1=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using COC1=CC(C(N)C#N)=C(Cl)C=C1Cl.N.O.O=S(=O)(O)O as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " COC1=CC(C(N)C(N)=O)=C(Cl)C=C1Cl ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " BrBr.CC(=O)O.CN1N=C(C2=C(Cl)C=CC=C2Cl)N=C1C1=CC=CS1.O=C([O-])O.[Na+] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CN1N=C(C2=C(Cl)C=CC=C2Cl)N=C1C1=CC=C(Br)S1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using BrBr.C1COCCO1.CC(=O)C1=CC=CC(F)=C1 as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " O=C(CBr)C1=CC=CC(F)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C.CC1=CC2=C(OC(CN)C2C)C2=C1NC(=O)C=C2.Cl.O.[H][H].[Pd] as the reactants and reagents.",
"input": "",
"output": " CC1=CC2=C(OC(CN)C2C)C2=C1NC(=O)CC2 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CCCOC1=CC=C(C(=O)CBr)C=C1C1=NC(C(C)C)=C(Br)C(=O)N1.CN1CCNCC1 ",
"input": "",
"output": " CCCOC1=CC=C(C(=O)CN2CCN(C)CC2)C=C1C1=NC(C(C)C)=C(Br)C(=O)N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC(C)(C)CC(=O)NC1=NN2C=CC=NC2=C1C1=CC=CN=C1.OB(O)/C=C/C1=CC=C(C(F)(F)F)C=C1 as the reactants and reagents.",
"input": "",
"output": " CC(C)(C)CC(=O)NC1=NN2C=CC=NC2=C1/C=C/C1=CC=C(C(F)(F)F)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C=CC[C@@]1(C)C[C@H](C2=CC=CC(Cl)=C2)[C@@H](C2=CC=C(Cl)C=C2)NC1=O.CC1=CC([N+](=O)[O-])=CN=C1Cl Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be C=CC[C@@]1(C)C[C@H](C2=CC=CC(Cl)=C2)[C@@H](C2=CC=C(Cl)C=C2)N(C2=NC=C([N+](=O)[O-])C=C2C)C1=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CC1=CC(C)=C(N2CCNCC2)N=C1C.CC1=CC(N2CCCS2(=O)=O)=CC=C1C(=O)O as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CC1=CC(N2CCCS2(=O)=O)=CC=C1C(=O)N1CCN(C2=NC(C)=C(C)C=C2C)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCOC(=N)C1=C(F)C=CC=C1F.O=C=NC1=CC(Cl)=C(OC2=NC=C(C(F)(F)F)C=C2Cl)C(Cl)=C1 Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CCOC(=NC(=O)NC1=CC(Cl)=C(OC2=NC=C(C(F)(F)F)C=C2Cl)C(Cl)=C1)C1=C(F)C=CC=C1F .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1COCCO1.Cl.O=C1C2=C(NN(C3CCCCO3)C2)C2=CC(F)=C(C3=CC=CC=N3)C=C2N1CC(F)(F)F as the reactants and reagents.",
"input": "",
"output": " O=C1C2=C(NN=C2)C2=CC(F)=C(C3=CC=CC=N3)C=C2N1CC(F)(F)F ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CN(C)C=O.CN1C=C(C2=C(C3=C4CC(C#N)CCN4C4=CC=CC=C34)C(=O)OC2=O)C2=CC=CC=C21.N is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CN1C=C(C2=C(C3=C4CC(C#N)CCN4C4=CC=CC=C34)C(=O)NC2=O)C2=CC=CC=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CN(C)C=O.CN1CCOCC1.COC1=CC=CC=C1S(=O)(=O)N(CC1=CC=CC=C1C(=O)O)C(CN)CC1=CC=CC=C1.[N-]=[N+]=NP(=O)(C1=CC=CC=C1)C1=CC=CC=C1 as the reactants and reagents.",
"input": "",
"output": " COC1=CC=CC=C1S(=O)(=O)N1CC2=CC=CC=C2C(=O)NCC1CC1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC(C)=O.CCOCC.C[C@H](N)C1=CC=C([N+](=O)[O-])C=C1.Cl.O=C(Cl)OCC1=CC=CC=C1.[Na+].[OH-] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: C[C@H](NC(=O)OCC1=CC=CC=C1)C1=CC=C([N+](=O)[O-])C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CCN(CC)CC.CN(C)C=O.COC(=O)N=C(SC)C(=NC1=CC=C(C2=NOC(C)=N2)C=C1)C1=CC(OC)=C2OCCCC2=C1F.NNC1=NC=CC=N1 , what product could potentially be produced?",
"input": "",
"output": "The product can be COC1=CC(C(NC2=CC=C(C3=NOC(C)=N3)C=C2)C2=NN(C3=NC=CC=N3)C(=O)N2)=C(F)C2=C1OCCC2 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC(C)(C)OC(=O)NC1=CSC=C1NC(=O)C1=CC=C(COS(C)(=O)=O)C=N1.CCOC(C)=O.CN(C)CCN.ClCCl.O ",
"input": "",
"output": " CN(C)CCNCC1=CC=C(C(=O)NC2=CSC=C2NC(=O)OC(C)(C)C)N=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC1(C)C=CC(=O)CC1.CCOC(C)=O.[H][H].[Pd] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CC1(C)CCC(=O)CC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C1=CC=C([PH](C2=CC=CC=C2)(C2=CC=CC=C2)[Pd]([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)[PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.C1COCCO1.COC1=CC=CC(C2=NC(SC)=NC(Cl)=C2C#N)=C1 .",
"input": "",
"output": " C=CC1=NC(SC)=NC(C2=CC=CC(OC)=C2)=C1C#N ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC(C)NN.CCO.CCOC=C(C(=O)OCC)C(=O)OCC.CC[O-].Cl.O.[Cl-].[Na+] ",
"input": "",
"output": " CCOC(=O)C1=CN(C(C)C)N=C1O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C1CCNCC1.C1CCOC1.CCOC(C)=O.CN(C)C=O.O.O=C(CCCCC1SCC2NC(=O)NC21)NC1=CC=C(NC(=O)OCC2C3=CC=CC=C3C3=CC=CC=C32)C=C1O.[Cl-].[Na+] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: NC1=CC=C(NC(=O)CCCCC2SCC3NC(=O)NC32)C(O)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC(C)=O.CCC(O)(C1=NN(CC2=CC=C3C(C4=CC=C(F)C=C4)=CC(C#N)=NC3=C2)N=N1)C(F)(F)F.O.O=C([O-])[O-].OO.[Cl-].[NH4+].[Na+] ",
"input": "",
"output": " CCC(O)(C1=NN(CC2=CC=C3C(C4=CC=C(F)C=C4)=CC(C(N)=O)=NC3=C2)N=N1)C(F)(F)F ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C1=CC=CC=C1.CC1=CC=C(S(=O)(=O)O)C=C1.COC(=O)C(C)C(OC)OC.NC1=CC([N+](=O)[O-])=CC=C1Br as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " COC(=O)C(C)=CNC1=CC([N+](=O)[O-])=CC=C1Br ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using NC1=CC=CC(Cl)=C1Cl.O.O=N[O-].O=S(=O)(O)O.[C-]#N.[Na+].[OH-] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " N#CC1=CC=CC(Cl)=C1Cl ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC(=O)O.CC(=O)[O-].COC1=CC(C=O)=C2CCCC2=C1OC.C[N+](=O)[O-].[NH4+] .",
"input": "",
"output": " COC1=CC(C=C[N+](=O)[O-])=C2CCCC2=C1OC ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCOC(=O)CCCBr.CS(C)=O.OC1=CC=C(CCNCC(O)COC2=CC=CC=C2)C=C1 Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CCOC(=O)CCCOC1=CC=C(CCNCC(O)COC2=CC=CC=C2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC#N.FC(F)(Br)C(F)(F)OC1=CC=CC(Br)=C1.[Zn] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " FC(F)=C(F)OC1=CC=CC(Br)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC1=CC=C(S(=O)(=O)OCCCCCCCCCOC2=CC=CC(C(N)=O)=C2)C=C1.CCO.O.[C-]#N.[Na+] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " N#CCCCCCCCCCOC1=CC=CC(C(N)=O)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)(C)OC(=O)N1C2CCC(N=C=O)C1CC2.CCN(C(C)C)C(C)C.CN(C)C=O.CN1N=CC2=CC(C3=NNC4=C3CNCC4)=CC=C21 Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CN1N=CC2=CC(C3=NNC4=C3CN(C(=O)NC3CCC5CCC3N5C(=O)OC(C)(C)C)CC4)=CC=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC1=CC=C(N(C)C(=O)CN(C(=O)CN2C(=O)C3=CC=CC=C3C2=O)C2=CC=CC=C2)C=C1.CC1=CC=CC(N=C=O)=C1.NN.O .",
"input": "",
"output": " CC1=CC=C(N(C)C(=O)CN(C(=O)CNC(=O)NC2=CC=CC(C)=C2)C2=CC=CC=C2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C1CCOC1.C=C(OCC)C1=CC=CC=C1CC1=NC2=C(NC3=CC=C(C(F)(F)F)C=C3)N=CN=C2S1.CCOC(C)=O.Cl is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC(=O)C1=CC=CC=C1CC1=NC2=C(NC3=CC=C(C(F)(F)F)C=C3)N=CN=C2S1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with COC(=O)/C=C/C1=CC=CC(Cl)=C1C.CS(C)=O.C[S+](C)(C)=O.[H-].[I-].[Na+] as the reactants and reagents.",
"input": "",
"output": " COC(=O)[C@@H]1C[C@H]1C1=CC=CC(Cl)=C1C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C1=CC=C(P(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.C=CCN(C)C[C@@H](C)OC1=CC=CC2=NC=NC(NC3=CC=C(OCC4=CC=CC=N4)C(Cl)=C3)=C12.CC#N.O.[Cl-].[Rh] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CNC[C@@H](C)OC1=CC=CC2=NC=NC(NC3=CC=C(OCC4=CC=CC=N4)C(Cl)=C3)=C12 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CC#N.CCC1=NN(C2=C(C)C=C(C)C=C2C)C(CC)=C1CO.CCN(CC)CC.CN(C)C=O.CS(=O)(=O)Cl.ClCCl.O.OCC1CC2=CC=CC=C2CN1 as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CCC1=NN(C2=C(C)C=C(C)C=C2C)C(CC)=C1CN1CC2=CC=CC=C2CC1CO ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC#N.CCC1=NN(C2=C(C)C=C(C)C=C2C)C(CC)=C1CO.CCN(CC)CC.CN(C)C=O.CS(=O)(=O)Cl.ClCCl.O.OCC1CC2=CC=CC=C2CN1 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CCC1=NN(C2=C(C)C=C(C)C=C2C)C(CC)=C1CN1CC2=CC=CC=C2C[C@@H]1CO ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1=CC=NC=C1.C1CCOC1.N#CC1=CC=C(C(=O)Cl)C=C1.NC1=CC=CC(C(=O)NC2=C(Br)C=C(C(O)(C3=CC(Cl)=CC(Cl)=C3)C(F)(F)F)C=C2Br)=C1.O=C([O-])O.[Na+] as the reactants and reagents.",
"input": "",
"output": " N#CC1=CC=C(C(=O)NC2=CC=CC(C(=O)NC3=C(Br)C=C(C(O)(C4=CC(Cl)=CC(Cl)=C4)C(F)(F)F)C=C3Br)=C2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1=CC=C(P(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.CC1=CC=CC(C)=C1.O=C(O)C1=CC=C(CCBr)C=C1 ",
"input": "",
"output": " O=C(O)C1=CC=C(CC[P+](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.[Br-] ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C1CCOC1.CO.N#C[C@@H]1C[C@@]2(C3=CC=CC=C3)C(=O)CC[C@@H]1N2CC1=CC=CC=C1.[BH4-].[Na+] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: N#C[C@@H]1C[C@@]2(C3=CC=CC=C3)[C@H](O)CC[C@@H]1N2CC1=CC=CC=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC1=CC=C(C(=O)NC2=CC=CC(N3CCOCC3)=C2)C=C1B1OC(C)(C)C(C)(C)O1.CC1=NOC2=CC(Br)=CC=C12 Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CC1=CC=C(C(=O)NC2=CC=CC(N3CCOCC3)=C2)C=C1C1=CC=C2C(C)=NOC2=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CC1=CC=CC=C1.COC(OC)N(C)C.O=C(CC(=O)C1=CC=CC=C1)C1=CC=CC=C1 as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CN(C)C=C(C(=O)C1=CC=CC=C1)C(=O)C1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC1=C2C(=O)NCCN2C2=C(Br)C=C(Cl)C=C12.OB(O)C1=CC=C(Cl)C(Cl)=C1 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CC1=C2C(=O)NCCN2C2=C(C3=CC=C(Cl)C(Cl)=C3)C=C(Cl)C=C12 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.CC(C)(C)OC(=O)CCC1=NC(CC(NC(=O)OC(C)(C)C)C(=O)O)=CC=C1F.CCOC(C)=O.Cl.O.[Li+].[OH-] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CC(C)(C)OC(=O)/C=C/C1=NC(CC(NC(=O)OC(C)(C)C)C(=O)O)=CC=C1F .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1COCCO1.CC(C)OC(N)=NO.CCC1=CC=C(C2CC(C(=O)O)CN(C(=O)N3CCC(O)CC3)C2)C=C1.CN(C)C=O.O=C(N1C=CN=C1)N1C=CN=C1 Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CCC1=CC=C(C2CC(C3=NC(OC(C)C)=NO3)CN(C(=O)N3CCC(O)CC3)C2)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C1CCOC1.CC1=CC=C(S(=O)(=O)Cl)C=C1.COC1=CC(C2=CN=C3NC=C(I)C3=N2)=CC(OC)=C1OC.[H-].[Na+] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " COC1=CC(C2=CN=C3C(=N2)C(I)=CN3S(=O)(=O)C2=CC=C(C)C=C2)=CC(OC)=C1OC ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CC=C2SC=CC2=C1.C1CCOC1.CCCCC.CN(C)C1(CC2=CC=CC=C2)CCC(=O)CC1.[Li]C(C)(C)C Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CN(C)C1(CC2=CC=CC=C2)CCC(O)(C2=CC3=CC=CC=C3S2)CC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " Cl.NC1=CC=CC=C1.NC1=CN=[N+](C2=CC=CC=C2)C(Cl)=C1Cl.O.[Cl-] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " NC1=CN=[N+](C2=CC=CC=C2)C(NC2=CC=CC=C2)=C1Cl ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CC(C)(C)C1=CC(C(=NO)C2=CC=CC=C2)=CC(C(C)(C)C)=C1O.CCCCCCCC(=O)Cl as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CCCCCCCC(=O)ON=C(C1=CC=CC=C1)C1=CC(C(C)(C)C)=C(O)C(C(C)(C)C)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CC(C)N1CCN(C(=O)C2=CC=C(C3=CN=CC(B4OC(C)(C)C(C)(C)O4)=C3)C=C2)CC1.CC1=CC=CC(C2=NC(Cl)=CC(Cl)=N2)=N1 as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CC1=CC=CC(C2=NC(Cl)=CC(C3=CN=CC(C4=CC=C(C(=O)N5CCN(C(C)C)CC5)C=C4)=C3)=N2)=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: COC(=O)C1=C2C=CC=CC2=CC=[N+]1[O-].O=P(Cl)(Cl)Cl .",
"input": "",
"output": " COC(=O)C1=NC(Cl)=CC2=CC=CC=C12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C1CCOC1.CC(C)N1CCN2C1=CC(Cl)=NC2=O.CN(C)C=O.N#CC1=CC=CC(CO)=C1.[H-].[Na+] , what product could potentially be produced?",
"input": "",
"output": "The product can be CC(C)N1CCN2C1=CC(OCC1=CC=CC(C#N)=C1)=NC2=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(=O)O.CCOC(OCC)OCC.NC1=CC=C(SC(F)F)C=C1.[N-]=[N+]=[N-].[Na+] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be FC(F)SC1=CC=C(N2C=NN=N2)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CCOC(=O)C1=CC2=CC=CC=C2N1.CN(C)C=O.O=C(CBr)OCC1=CC=CC=C1.[H-].[Na+] ",
"input": "",
"output": " CCOC(=O)C1=CC2=CC=CC=C2N1CC(=O)OCC1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CN(C)C1=CC=C(C(=O)O)C=C1.CN(C)C1=CC=C(C2=NC3=NC=C(N)C=C3N2)C=C1 .",
"input": "",
"output": " CN(C)C1=CC=C(C(=O)NC2=CN=C3N=C(C4=CC=C(N(C)C)C=C4)NC3=C2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC(C)(C)OC(=O)NC1=CC=C(C2=CC=CS2)C=C1N.CN(C)[C@@H]1CCN(CC2=CC=C(C(=O)O)C=C2)C1.O=C(NC1=CC=C(C(=O)O)C=C1)OCC1=CC=CN=C1 ",
"input": "",
"output": " NC1=CC=C(C2=CC=CS2)C=C1NC(=O)C1=CC=C(NC(=O)OCC2=CC=CN=C2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(=O)N(C)C.CC(C)(C)C(=O)OCCl.O.O=C(O)C1(C(=O)OCC2=CC=CC=C2)CCN(CC2=CC=C(C3=NOC(C4=CC=C(C5=CC=CC=C5)C(F)=C4)=N3)C=C2)CC1.O=C([O-])[O-].[Na+] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CC(C)(C)C(=O)OCOC(=O)C1(C(=O)OCC2=CC=CC=C2)CCN(CC2=CC=C(C3=NOC(C4=CC=C(C5=CC=CC=C5)C(F)=C4)=N3)C=C2)CC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CO.COC1=CC=C(CC2=CC([C@]3(OC)O[C@](C=O)(CO)[C@@H](OCC4=CC=CC=C4)[C@H](OCC4=CC=CC=C4)[C@H]3OCC3=CC=CC=C3)=CC=C2Cl)C(F)=C1F.[BH4-].[Na+] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " COC1=CC=C(CC2=CC([C@]3(OC)OC(CO)(CO)[C@@H](OCC4=CC=CC=C4)[C@H](OCC4=CC=CC=C4)[C@H]3OCC3=CC=CC=C3)=CC=C2Cl)C(F)=C1F ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC1CCN(C2=CC3=C(C=C2N)SC(C(C)(C)C)=N3)CC1.ClC(Cl)Cl.O=C([O-])O.S=C(Cl)Cl.[K+] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CC1CCN(C2=CC3=C(C=C2N=C=S)SC(C(C)(C)C)=N3)CC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC1=C(C)C2=C(CCC(C)(C(=O)N(CCO)CCO)O2)C(C)=C1O.O=[N+]([O-])[O-].[Ce+4].[NH4+] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC1=C(C)C(=O)C(CCC(C)(O)C(=O)N(CCO)CCO)=C(C)C1=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C1=CC=C([P+](CC2=CC=C3C=CC=CC3=N2)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.C1CCOC1.CC1=C(C)C2=C(CCC3(CCC3)O2)C(C=O)=C1O.C[O-].[Br-].[Na+] , what product could potentially be produced?",
"input": "",
"output": "The product can be CC1=C(C)C2=C(CCC3(CCC3)O2)C(/C=C\\C2=CC=C3C=CC=CC3=N2)=C1O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C=CC/C=C\\C/C=C\\CCCCCCCC1=CC=CC(O)=C1.CC(C)(C)Cl.O.[Al+3].[Cl-] as the reactants and reagents.",
"input": "",
"output": " CCCCCCCCCCCCCC(CC1=CC=CC=C1O)C(C)(C)C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CSC1=CC=CC=C1.O=C(N[C@H]1CN(C(=O)NS(=O)(=O)NC(=O)N2CCN(C3=CC=C(O)C(O)=C3)C2=O)C1=O)OCC1=CC=CC=C1.O=C(O)C(F)(F)F.[NaH] .",
"input": "",
"output": " N[C@H]1CN(C(=O)NS(=O)(=O)NC(=O)N2CCN(C3=CC=C(O)C(O)=C3)C2=O)C1=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C1CCNC1.CC(=O)C1=CC2=C(C=C1O)OCO2.CCO.CO.Cl.O=C1CCN(CCC2=CC=CC=C2)CC1 .",
"input": "",
"output": " O=C1CC2(CCN(CCC3=CC=CC=C3)CC2)OC2=CC3=C(C=C12)OCO3 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC1(C)OC2=CC=C(Br)C=C2O1.CCCCCC.CN(C)C=O.O=CC1=CC=C(C2CC2)C=C1.[Li]CCCC ",
"input": "",
"output": " CC1(C)OC2=CC=C(C=O)C=C2O1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C1CCOC1.CO.COC(=O)C(CC(=O)C1=CC=C(C2=CC=C(C3=CC=CC4=C3OC3=CC=CC=C34)C=C2)C=C1)CC1=CC=CC(C(F)(F)F)=C1.Cl.O.[Na+].[OH-] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " O=C(CC(CC1=CC=CC(C(F)(F)F)=C1)C(=O)O)C1=CC=C(C2=CC=C(C3=CC=CC4=C3OC3=CC=CC=C34)C=C2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C1=CC=C(P(C2=CC=CC=C2)[C-]2C=CC=C2)C=C1.C1COCCO1.CCC(C)N1C(Br)=NC2=C(C3=CN=C(N)N=C3)N=C(N3CCOCC3)N=C21.CO.C[Zn]C.Cl[Pd]Cl.[Fe+2] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CCC(C)N1C(C)=NC2=C(C3=CN=C(N)N=C3)N=C(N3CCOCC3)N=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC(=O)O.CCCCCCCCC#CC1=CC=C(C=O)C=C1.CCN(C(C)C)C(C)C.COC(=O)COC1=CC=C(CN)C=C1 , what product could potentially be produced?",
"input": "",
"output": "The product can be CCCCCCCCC#CC1=CC=C(CNCC2=CC=C(OCC(=O)OC)C=C2)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: COC1=CC=C(C2=CC=NN2C2=CC=CC=C2Cl)C(OC)=C1.O=S(=O)(O)Cl .",
"input": "",
"output": " COC1=CC(OC)=C(S(=O)(=O)Cl)C=C1C1=CC=NN1C1=CC=CC=C1Cl ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC(=O)O.CCOC(=O)C1=CNC2=C1C(=O)C(=CN(C)C)CCC2.NN .",
"input": "",
"output": " CCOC(=O)C1=CNC2=C1C1=NNC=C1CCC2 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC#N.COC1=N[C@H](C(C)C)C(OC)=N[C@H]1CC1=CC(F)=CC(Br)=C1.Cl.[Na+].[OH-] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: COC(=O)[C@@H](N)CC1=CC(F)=CC(Br)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) BrCCCC1CCCO1.CCCCOC1=NC2=NC(OC)=NC2=C(N)N1.O=C(O)C(F)(F)F as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CCCCOC1=NC(N)=C2N=C(OC)N(CCCC3CCCO3)C2=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1=CC=C(CNCC(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.CCOC(C)=O.O=C=NC1=CC=C(F)C=C1F ",
"input": "",
"output": " O=C(NC1=CC=C(F)C=C1F)N(CC1=CC=CC=C1)CC(C1=CC=CC=C1)C1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC#N.CC1=CC=CC=C1I.CCCC1CCCCN1CCCC#N.CCOCC.ClCCl.O=C(O)C(F)(F)F Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CCCC1CCCCN1CCCC(=O)C1=CC=CC=C1C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC#N.CC(C)(C)OC(=O)NC(CC1=CC=CC(OC(F)(F)C(F)F)=C1)C(O)C1=CC=C(OC2=CC=CC=N2)C=C1.CCN=C=NCCCN(C)C.Cl.O.O=C(O)C(F)(F)F.O=C(O)C1=CC=CC2=C1C=CCCC2.O=C([O-])O.ON1N=NC2=CC=CC=C21.[Na+] .",
"input": "",
"output": " O=C(NC(CC1=CC=CC(OC(F)(F)C(F)F)=C1)C(O)C1=CC=C(OC2=CC=CC=N2)C=C1)C1=CC=CC2=C1C=CCCC2 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1CCOC1.CC(C)C[Al+]CC(C)C.CCOC(=O)CC1=CC=C2C(=C1)SC1=NC=NC(NC3=CC=C(OCC4=CC=CC(F)=C4)C(Cl)=C3)=C12.[H-] as the reactants and reagents.",
"input": "",
"output": " OCCC1=CC=C2C(=C1)SC1=NC=NC(NC3=CC=C(OCC4=CC=CC(F)=C4)C(Cl)=C3)=C12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCN(C(C)C)C(C)C.CN(C)C=O.C[C@@H](O)C(=O)O.ClCCCl.NC1=C2CNCC2=NC2=C(C3=CC=C(C4=CC=CC=C4)N=C3)C=NN12.ON1N=NC2=CC=CC=C21 Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " C[C@@H](O)C(=O)N1CC2=NC3=C(C4=CC=C(C5=CC=CC=C5)N=C4)C=NN3C(N)=C2C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CC(=O)O.CC(=O)O[BH-](OC(C)=O)OC(C)=O.CC(C)(C)OC(=O)N1CCC(N)CC1.ClCCCl.O=CC1=C(Cl)N=C(Cl)S1.[Na+].[OH-] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CC(C)(C)OC(=O)N1CCC(NCC2=C(Cl)N=C(Cl)S2)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(CN1CCCC1)N1C2=CC=CC=C2SC2=CC=C(C(N)=S)C=C21.CCO.NCC1=CC=CC(F)=C1.S Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CC(CN1CCCC1)N1C2=CC=CC=C2SC2=CC=C(C(=S)NCC3=CC=CC(F)=C3)C=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC(C)[C@H](O)C(=O)O.CCCC(N)C(=O)NC1=CN(C(C)(C)CC(=O)OC)C=N1 , what product could potentially be produced?",
"input": "",
"output": "The product can be CCCC(NC(=O)C(O)C(C)C)C(=O)NC1=CN(C(C)(C)CC(=O)OC)C=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CNC(=O)CC(C1=CC=CN=C1)C1=CC=C2C(OC)=NNC2=C1.CNCCC(C1=CC=CC=C1)C1=CC=CC2=C1NC=C2.O=C(O)C(F)(F)F as the reactants and reagents.",
"input": "",
"output": " CNCCC(C1=CC=CN=C1)C1=CC=C2C(OC)=NNC2=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1CCOC1.C=C(C(=O)OC)C1=CC=CC(N)=C1.O.O=C(Cl)C=CC1=CC=CC=C1.O=C([O-])O.[Na+] as the reactants and reagents.",
"input": "",
"output": " COC(=O)C=CC1=CC=CC(NC(=O)C=CC2=CC=CC=C2)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CCOC(=O)C1=CC2=CC(Cl)=CC(C=O)=C2OC1C(F)(F)F.NC1=CC=CC=C1N.O=[N+]([O-])C1=CC=CC=C1 , what product could potentially be produced?",
"input": "",
"output": "The product can be CCOC(=O)C1=CC2=CC(Cl)=CC(C3=NC4=CC=CC=C4N3)=C2OC1C(F)(F)F .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC(C)CCON=O.CC1=NN(C2=CC=CC=C2)C(N)=C1.CCO.Cl , what product could potentially be produced?",
"input": "",
"output": "The product can be CC1=NN(C2=CC=CC=C2)C(N)=C1N=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C1CCOC1.CCC1(CC(=O)O)OCCC2=C1NC1=CC(OC(F)(F)F)=CC=C21.O=C1OC(Br)C2=CC=CC=C12 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CCC1(CC(=O)OC2OC(=O)C3=CC=CC=C32)OCCC2=C1NC1=CC(OC(F)(F)F)=CC=C21 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C1=CC=C2C(=C1)C=NC1=CC=CC=C12.C1=CC=C2NC=CC2=C1.COC1=CC=CC(C(=O)Cl)=C1 , what product could potentially be produced?",
"input": "",
"output": "The product can be COC1=CC=CC(C(=O)N2C3=CC=CC=C3C3=CC=CC=C3C2C2=CNC3=CC=CC=C23)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CCOC(=O)C1=C(OC(C)C)C=C(OC(C)C)N=C1C.CO.O.[Na+].[OH-] ",
"input": "",
"output": " CC1=NC(OC(C)C)=CC(OC(C)C)=C1C(=O)O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C(=NC1CCCCC1)=NC1CCCCC1.C1CCOC1.CC1=CC=C2C3=C(C=CC2=N1)OC[C@H](CN)O3.CCN(CC)CC.Cl.O=C(O)C1CCC2=C(C1)NC1=CC=C(F)C=C21.ON1N=NC2=CC=CC=C21 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CC1=CC=C2C3=C(C=CC2=N1)OC[C@H](CNC(=O)C1CCC2=C(C1)NC1=CC=C(F)C=C21)O3 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CN(C)CCN(CCNC1=CC=C([N+](=O)[O-])C=N1)S(=O)(=O)C1=CC=CC=C1[N+](=O)[O-].OCCN1CCOCC1 as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " O=[N+]([O-])C1=CC=C(NCCN(CCN2CCOCC2)S(=O)(=O)C2=CC=CC=C2[N+](=O)[O-])N=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CCO.COC(=O)[C@H](CC1CCC(O[Si](C)(C)C(C)(C)C)CC1)NC(=O)OC(C)(C)C.[BH4-].[Na+] ",
"input": "",
"output": " CC(C)(C)OC(=O)N[C@H](CO)CC1CCC(O[Si](C)(C)C(C)(C)C)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " ClCCl.OCC1=C(CN2CCC(C(F)(F)F)CC2)N=C(C2=CC=C(C(F)(F)F)C=C2)S1.[Mn+4].[O-2] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be O=CC1=C(CN2CCC(C(F)(F)F)CC2)N=C(C2=CC=C(C(F)(F)F)C=C2)S1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C#CC1(O)CCOC1.NC(=O)C1=CN2CCOC3=CC(F)=C(Br)C=C3C2=N1 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " NC(=O)C1=CN2CCOC3=CC(F)=C(C#CC4(O)CCOC4)C=C3C2=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC(=O)OC(C)=O.CN(C)C1=CC=CC=N1.ClCCl.O=C1C2CC3CC1CC(O)(C3)C2 ",
"input": "",
"output": " CC(=O)OC12CC3CC(C1)C(=O)C(C3)C2 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CC=C([PH](C2=CC=CC=C2)(C2=CC=CC=C2)[Pd]([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)[PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.CC1(C)OB(C2=CN=C(N)N=C2)OC1(C)C.CC1=CC=CC=C1.CCO.COC(=O)C1=CC=C(Br)C=C1Cl.O.O=C([O-])[O-].[K+] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be COC(=O)C1=CC=C(C2=CN=C(N)N=C2)C=C1Cl .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " Br.CC(=O)O.CCOCC.COC1=NC2=CC([N+](=O)[O-])=CC(COCC(=O)OC(C)(C)C)=C2N=C1OC Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be O=C(O)COCC1=CC([N+](=O)[O-])=CC2=C1NC(=O)C(=O)N2 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CCO.Cl.N#CCC#N.O.O=CC1=CC=CC(Cl)=C1Cl.[BH4-].[Na+] ",
"input": "",
"output": " N#CC(C#N)CC1=CC=CC(Cl)=C1Cl ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1COCCO1.CC1=CC(Cl)=C(OCCOC2=CC=C([C@H]3CCN(C(=O)OC(C)(C)C)C[C@@H]3C(=O)N(CC3=CC=CC(C)=C3C)C3CC3)C=C2)C(Cl)=C1.Cl.ClCCl Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CC1=CC(Cl)=C(OCCOC2=CC=C([C@H]3CCNC[C@@H]3C(=O)N(CC3=CC=CC(C)=C3C)C3CC3)C=C2)C(Cl)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC1(C)C=C(C2=CC=C(C(=O)O)C=N2)C2=CC(C#N)=CC=C2O1.CCOC(C)=O.[Pd] , what product could potentially be produced?",
"input": "",
"output": "The product can be CC1(C)CC(C2=CC=C(C(=O)O)C=N2)C2=CC(C#N)=CC=C2O1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CC1(C)C(=O)N(Br)C(=O)N1Br.CCCCCCCCCCC1=CC(C)=C2CCN(C)C2=N1.ClC(Cl)Cl as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CCCCCCCCCCC1=NC2=C(CCN2C)C(C)=C1Br .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CC(C)S(=O)(=O)NC1CCCC1(O)C1=CC=C(OCC#N)C=C1.CCN(CC)S(F)(F)F as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CC(C)S(=O)(=O)NC1CCCC1(F)C1=CC=C(OCC#N)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC(C)O.Cl.O=C(C(O)(CN1C=NC=N1)C1=CC=C(F)C=C1)C(F)(F)C(F)(F)F.[BH4-].[Na+] as the reactants and reagents.",
"input": "",
"output": " OC(C(O)(CN1C=NC=N1)C1=CC=C(F)C=C1)C(F)(F)C(F)(F)F ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C1COCCOCCOCCOCCOCCO1.CC#N.CC(C)(C)OC(=O)N1[C@H](CF)[C@@H](C2=CC=C(C3=CC(COS(C)(=O)=O)=NO3)C=C2)OC1(C)C.CS(=O)[O-].[Na+] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC(C)(C)OC(=O)N1[C@H](CF)[C@@H](C2=CC=C(C3=CC(CS(C)(=O)=O)=NO3)C=C2)OC1(C)C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CCCBr.CS(C)=O.O[C@@H]1[C@@H](OCC2=CC=CC=C2)[C@@H](OC2CCCCO2)[C@@H]2OC[C@H]1O2.[K+].[OH-] ",
"input": "",
"output": " CCCO[C@@H]1[C@@H](OCC2=CC=CC=C2)[C@@H](OC2CCCCO2)[C@@H]2OC[C@H]1O2 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. C=CCN1C(=O)NC2=CC=CC=C21.CC[N+](CC)(CC)CC1=CC=CC=C1.ClCCCBr.O.[Cl-].[Na+].[OH-] ",
"input": "",
"output": " C=CCN1C(=O)N(CCCCl)C2=CC=CC=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC(=O)OC1=CC=CC(C(=O)O)=C1.CCN(C(C)C)C(C)C.NC1=CC=CC(C(F)(F)F)=C1.O=S(Cl)Cl , what product could potentially be produced?",
"input": "",
"output": "The product can be CC(=O)OC1=CC=CC(C(=O)NC2=CC=CC(C(F)(F)F)=C2)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. C=CCOCCCO.CCN(CC)CC.CS(C)=O.ClCCl.O=C(Cl)C(=O)Cl ",
"input": "",
"output": " C=CCOCCC=NO ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C1CCOC1.C=CCBr.CC(C)(C)OC(=O)N1CCC(C#N)CC1.CC(C)[N-]C(C)C.O=C(O)CC(O)(CC(=O)O)C(=O)O.[Li+] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " C=CCC1(C#N)CCN(C(=O)OC(C)(C)C)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: O=CC1=CC=C(F)C=C1.OC1=CC(Cl)=CC(Cl)=C1 .",
"input": "",
"output": " O=CC1=CC=C(OC2=CC(Cl)=CC(Cl)=C2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C1=CC2(CCNCC2)C2=CC=CC=C12.CCN(CC)CC.ClCCl.O=S(=O)(Cl)C1=CC=C(Br)C=C1 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: O=S(=O)(C1=CC=C(Br)C=C1)N1CCC2(C=CC3=CC=CC=C32)CC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC(=O)N1CCN(C(=O)C2=CC=C(NC3=NC=CC(C4=CC=C([N+](=O)[O-])C=C4)=N3)C=C2)CC1.CC(=O)O.CO.[Pd] ",
"input": "",
"output": " CC(=O)N1CCN(C(=O)C2=CC=C(NC3=NC=CC(C4=CC=C(N)C=C4)=N3)C=C2)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C1=CC=C(P(CCCP(C2=CC=CC=C2)C2=CC=CC=C2)C2=CC=CC=C2)C=C1.CC(=O)[O-].CC(C)(O)CC1=CC=C(Br)C=C1F.CCN(CC)CC.CN(C)C=O.CO.[Pd+2] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: COC(=O)C1=CC=C(CC(C)(C)O)C(F)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CCN(CC)CC.CCOC(=O)C(C)(C)OC1=CC=C(CCNCC2=CC=C(C(F)(F)F)C=C2)C=C1.ClCCl.N#CBr ",
"input": "",
"output": " CCOC(=O)C(C)(C)OC1=CC=C(CCN(C#N)CC2=CC=C(C(F)(F)F)C=C2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC(C)C[Al+]CC(C)C.Cl.ClCCl.O=C1CC2C=CCCC2O1.[H-] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: OC1CC2C=CCCC2O1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CCOC(C)=O.CI.CN(C)C=O.O.OC1=CC=CC=C1N1N=CN=N1.[Na+].[OH-] .",
"input": "",
"output": " CN1C=NN(C2=CC=CC=C2O)N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC(=O)N1CCNCC1.CC1=CC(CN(C)C)=CC(C)=C1O.CC1=CC=CC=C1C as the reactants and reagents.",
"input": "",
"output": " CC(=O)N1CCN(CC2=CC(C)=C(O)C(C)=C2)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C1=CC=C([PH](C2=CC=CC=C2)(C2=CC=CC=C2)[Pd]([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)[PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.C1CCOC1.CC(C)=O.CC1=CC=CC(I)=C1.CCCCCC.CCCN(CC1=CC=C(C2=CC=CC=C2C2=NN=NN2C(C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1)C1=NN(CCC2=CC=CC=C2)C(Br)=C1C(=O)OCC.CN1CCCN(C)C1=O.O=C=O.[Cl-].[Li]CCCC.[NH4+].[Zn+2] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CCCN(CC1=CC=C(C2=CC=CC=C2C2=NN=NN2C(C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1)C1=NN(CCC2=CC=CC=C2)C(C2=CC=CC=C2C)=C1C(=O)OCC .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC1=CC=C([N+](=O)[O-])C=C1C.CCC(=O)CC.O=C(O)C1=CC=CC=C1.[H][H].[Pd] as the reactants and reagents.",
"input": "",
"output": " CCCN(CC)C1=CC=C(C)C(C)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CCCCCCCCCCCCCCCCCC(=O)NC1=CC=CC=C1C(=O)O.CCN(CC)CC.CN(C)CCCN.ClC(Cl)Cl.ClCCl.O=P(Cl)(C1=CC=CC=C1)C1=CC=CC=C1 ",
"input": "",
"output": " CCCCCCCCCCCCCCCCCC(=O)NC1=CC=CC=C1C(=O)NCCCN(C)C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using B.C1CCOC1.COC1=CC=C(F)C(F)=C1COC1=CC(N2C(=O)NC3=CC=C(C(=O)O)N=C32)=C(Cl)C=C1OCCO.O.[Cl-].[NH4+] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " COC1=CC=C(F)C(F)=C1COC1=CC(N2C(=O)NC3=CC=C(CO)N=C32)=C(Cl)C=C1OCCO ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CC(C)(C)C1=CC=C(O)C=C1.CC1=CC=CC=C1C.COCCOCCOC.CS(=O)(=O)NC1=CC=C(Cl)C([N+](=O)[O-])=C1.Cl.O.O=C([O-])[O-].[K+] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CC(C)(C)C1=CC=C(OC2=CC=C(NS(C)(=O)=O)C=C2N)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC1=CN=C2C(Br)=NC=C(Br)N12.CCCCO.CCN(C(C)C)C(C)C.NC1=CC=C(N2CCOCC2)C=C1 Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CC1=CN=C2C(NC3=CC=C(N4CCOCC4)C=C3)=NC=C(Br)N12 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1COCCN1.ClC1=CC=C2C(I)=CC=CC2=N1.N[C@@H]1CCC2=CC=CC=C21 ",
"input": "",
"output": " C1=CC=C2C(=C1)CC[C@H]2NC1=CC=C2C(N3CCOCC3)=CC=CC2=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.CC(C)(C)[O-].Cl.O=S(=O)(CCl)C1=CC=CC2=CC=CC=C12.O=[N+]([O-])C1=CC=C(OCCCCCl)C=C1.[K+] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " O=[N+]([O-])C1=CC=C(OCCCCCl)C=C1CS(=O)(=O)C1=CC=CC2=CC=CC=C12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. C1CCC2=NCCCN2CC1.C=CCBr.CN(C)C=O.NCC1=NOC(C2=C3[C@@H]4CCN4C(=O)C4=C(Cl)C=CC=C4N3C=N2)=N1 ",
"input": "",
"output": " C=CCN(CC=C)CC1=NOC(C2=C3[C@@H]4CCN4C(=O)C4=C(Cl)C=CC=C4N3C=N2)=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC1=CC=CC(N=C=O)=C1.CCN1C2=CC=CC=C2C2=CC(N)=CC=C21.CCON=C1C[C@@H](C(=O)O)N(C(=O)OC(C)(C)C)C1 ",
"input": "",
"output": " CCON=C1C[C@@H](C(=O)NC2=CC=C3C(=C2)C2=CC=CC=C2N3CC)N(C(=O)NC2=CC=CC(C)=C2)C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1CCOC1.CC1(C)OC[C@@H](COC2=CC=C(CCCC(C#N)N=C(C3=CC=CC=C3)C3=CC=CC=C3)C=C2)O1.Cl.O=C([O-])O.[Na+] ",
"input": "",
"output": " CC1(C)OC[C@@H](COC2=CC=C(CCCC(N)C#N)C=C2)O1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC(C)(C)OC(=O)N1C=CN(C[C@H]2NC(=O)[C@H]2NC(=O)OCC2=CC=CC=C2)C1=O.[Pd] .",
"input": "",
"output": " CC(C)(C)OC(=O)N1C=CN(C[C@H]2NC(=O)[C@H]2N)C1=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC1=CC(F)=CC=C1C1=NC(S(C)(=O)=O)=NC2=C1C=CC(=O)N2C1=C(F)C=CC=C1F.CCN(CC)CC.CN1CCCC1.Cl.NCCS(=O)(=O)O ",
"input": "",
"output": " CC1=CC(F)=CC=C1C1=NC(O)=NC2=C1C=CC(=O)N2C1=C(F)C=CC=C1F ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CCC1(C(=O)OC)CCC2C(C3=CC=C(Cl)C=C3)=NOC2(N2CCCC2)C1.Cl as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CCC1(C(=O)OC)CCC2=C(C1)ON=C2C1=CC=C(Cl)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses BrCCBr.CC#N.O=C([O-])[O-].OC1=C(F)C=CC=C1F.[K+] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: FC1=CC=CC(F)=C1OCCBr .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CCC1=CC2=C(C=CN(CC3=CC=C(OC)C=C3)C2=O)C=C1OC1CCN(C(=O)OC(C)(C)C)CC1.O=C1NC=CC2=CC(OC3CCNCC3)=C(Br)C=C12 as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CCC1=CC2=C(C=CNC2=O)C=C1OC1CCNCC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C#CC1=CC=CC=C1.CC(C)N(C=NC1=NC=C(I)C(Cl)=N1)C(C)C.CCN(CC)CC.Cl[Pd](Cl)([PH](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1)[PH](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1.I[Cu]I as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CC(C)N(C=NC1=NC=C(C#CC2=CC=CC=C2)C(Cl)=N1)C(C)C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. N=C(N)C1=CC=CC=C1.O=S(=O)(Cl)C=CC1=CC=CC=C1 ",
"input": "",
"output": " N=C(NS(=O)(=O)C=CC1=CC=CC=C1)C1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C=CC1=CC=C(C2=CC(NC(=O)C3CC4=CC=CC=C4C3)=NN2)C=C1.C=CCC1=CC=C(C2=CC(NC(=O)C3CC4=CC=CC=C4C3)=NN2)C=C1 ",
"input": "",
"output": " CCCC1=CC=C(C2=CC(NC(=O)C3CC4=CC=CC=C4C3)=NN2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " B.C1CCOC1.CC1=CC(Br)=CC=C1C1SCC(=O)NC2=C1C(C1=CC=CC=N1)=NN2C.Cl.[Na+].[OH-] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CC1=CC(Br)=CC=C1C1SCCNC2=C1C(C1=CC=CC=N1)=NN2C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CCOC(=O)C1=C(C)N(C)C(C2=CC=CC=C2)=C1Br.CO.C[O-].Cl.[Cu]I.[Na+] as the reactants and reagents.",
"input": "",
"output": " COC1=C(C2=CC=CC=C2)N(C)C(C)=C1C(=O)O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C=CCCCC(Br)CCC.CN1C=CC(=O)NC1=O.CS(C)=O.O.[H-].[Na+] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " C=CCCCCCCCN1C(=O)C=CN(C)C1=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC(=O)O.NC1=CC=C(C=C2SC(=O)NC2=O)C=C1 ",
"input": "",
"output": " NC1=CC=C(CC2SC(=O)NC2=O)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.CCOC(C)=O.CO.COC(=O)C1=CC=C(C(=O)NCC2=CC=CC3=C2C=CN3)C=C1Br.[Na+].[OH-] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " O=C(NCC1=CC=CC2=C1C=CN2)C1=CC=C(C(=O)O)C(Br)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1=CC=NC=C1.CC1=CC=C(S(=O)(=O)Cl)C=C1.ClCCl.OC[C@@H]1CCCO1 ",
"input": "",
"output": " CC1=CC=C(S(=O)(=O)OC[C@@H]2CCCO2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C1=CC=NC=C1.CC(C)(C)C1=CC(OCC2=CC=C(C(=O)O)C=C2)=CC(C(C)(C)C)=C1.NC1=NN=NN1.O.O=S(Cl)Cl as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CC(C)(C)C1=CC(OCC2=CC=C(C(=O)NC3=NN=NN3)C=C2)=CC(C(C)(C)C)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCOC(=O)COC1=CC(C)=C(S(=O)(=O)Cl)C=C1C.CCOC(=O)COC1=CC=C(S)C=C1C Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CCOC(=O)COC1=CC(C)=C(S)C=C1C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CN(C)C=O.CN1CC(=O)NC1=O.COC(=O)C1=CC=CC=C1CBr.[H-].[Na+] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be COC(=O)C1=CC=CC(CN2C(=O)CN(C)C2=O)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses NC1=NC=CS1.O=CC1=CC=CO1.[C-]#[N+]C(C)(C)C.[O-][Cl+3]([O-])([O-])O as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CC(C)(C)NC1=C(C2=CC=CO2)N=C2SC=CN12 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CC1=CC=CC=C1.CCOC(=O)C(OC1CCN(C)CC1)C1=CC=CC=C1.C[Al](C)C.NC1=CC(Cl)=C(Cl)C=C1N.[Na+].[OH-] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CN1CCC(OC(C2=CC=CC=C2)C2=NC3=CC(Cl)=C(Cl)C=C3N2)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC(C)(C)OC(=O)N(CCCO)S(=O)(=O)C1=CC=C(Br)C=C1.COC(=O)C1=CC=C(Br)C=C1.COC1=CC=C(CN(CC2=CC=C(OC)C=C2)C2=NC=C(C3=NC(N4CCOCC4)=NC4=C3CCN4)C=N2)C=C1 ",
"input": "",
"output": " COC1=CC=C(CN(CC2=CC=C(OC)C=C2)C2=NC=C(C3=NC(N4CCOCC4)=NC4=C3CCN4C3=CC=C(S(=O)(=O)NCCCO)C=C3)C=N2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CCN(C(C)C)C(C)C.CN1CCCC1=O.C[C@]1(CS(=O)(=O)Cl)NC(=O)NC1=O.ClC1=CC=C(C2=CC3=C(C=N2)CNCC3)C=C1.O as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: C[C@]1(CS(=O)(=O)N2CCC3=CC(C4=CC=C(Cl)C=C4)=NC=C3C2)NC(=O)NC1=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC1=C(C=C2CCC3=C(C2=O)C2=CC=CC(F)=C2N3C)N=CN1.CCO.[H][H].[Pd] .",
"input": "",
"output": " CC1=C(CC2CCC3=C(C2=O)C2=CC=CC(F)=C2N3C)N=CN1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C1N2CN3CN1CN(C2)C3.ClC(Cl)Cl.O=C(CBr)C1=CC=CC=C1 as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " O=C(C[N+]12CN3CN(CN(C3)C1)C2)C1=CC=CC=C1.[Br-] ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC(=O)OCC(CN[C@H](C)C1=CC=CC=C1)C1=CC=C(Br)C=C1.CO.[Na+].[OH-] ",
"input": "",
"output": " C[C@@H](NCC(CO)C1=CC=C(Br)C=C1)C1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C1CCOC1.CCO.N=C(N)N.O=[N+]([O-])C1=CC=CC=C1C([O-])=S as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " N=C(N)NC(=S)C1=CC=CC=C1[N+](=O)[O-] ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1CCOC1.CC(C)[N-]C(C)C.CCC1=CC=CC=C1.CCCCCCC.ClC1=CC=CC(Br)=C1.O=C=O.[Li+] ",
"input": "",
"output": " O=C(O)C1=C(Cl)C=CC=C1Br ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CCCCCCC.CCOC(C)=O.CNC1=CN=CC=C1C1=CC=CC=C1C.O=C(O)C1=CC(C(F)(F)F)=CC(C(F)(F)F)=N1 as the reactants and reagents.",
"input": "",
"output": " CC1=CC=CC=C1C1=CC=NC=C1N(C)C(=O)C1=CC(C(F)(F)F)=CC(C(F)(F)F)=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)(C)OC(=O)N1CC=C(C2=CC=C3C(N)=NC=NN23)CC1.NC1=NC=NN2C(Br)=CC=C12 Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CC1=NN2C(C3=CCN(C(=O)OC(C)(C)C)CC3)=CC=C2C(N)=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC1=NC2=C(C=CC3=CC(Cl)=CC=C3C2=O)O1.CN as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CC1=NC2=C(C=CC3=CC(Cl)=CC=C3C2=O)N1C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC1=C(C2=CC=C(OC(F)(F)F)C=C2)C(=O)N2C=CSC2=N1.CCCOC1=C(C=O)C=CC=C1OC.CCO.CC[O-].[Na+] , what product could potentially be produced?",
"input": "",
"output": "The product can be CCCOC1=C(/C=C/C2=C(C3=CC=C(OC(F)(F)F)C=C3)C(=O)N3C=CSC3=N2)C=CC=C1OC .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC(C)=O.CCN(CC)CC.O=C(CCCl)NS(=O)(=O)NC(=O)CCCl .",
"input": "",
"output": " C=CC(=O)NS(=O)(=O)NC(=O)C=C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CC=NC=C1.CCCCCCCCCCCCCCCC(=O)Cl.CCCCCCCCCCCCCCCCC(O)CSC[C@H](NC(=O)CCCCCCCCCCCCCCC)C(=O)OC(C1=CC=CC=C1)C1=CC=CC=C1.CO.ClC(Cl)Cl.ClCCl Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CCCCCCCCCCCCCCCCC(CSC[C@H](NC(=O)CCCCCCCCCCCCCCC)C(=O)OC(C1=CC=CC=C1)C1=CC=CC=C1)OC(=O)CCCCCCCCCCCCCCC .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C1CCNCC1.CC1=CC=CC=C1C.CCOC(=O)C[N+](=O)[O-].NC1=CC=C(I)C=C1C=O is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " O=C1NC2=CC=C(I)C=C2C=C1[N+](=O)[O-] ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1CCOC1.COC(=O)C1=CC=C(N(C(=O)OC(C)(C)C)C2=CC(N(C)C(=O)OC(C)(C)C)=NC=N2)C([N+](=O)[O-])=C1.[BH4-].[Li+] ",
"input": "",
"output": " CN(C(=O)OC(C)(C)C)C1=CC(N(C(=O)OC(C)(C)C)C2=CC=C(CO)C=C2[N+](=O)[O-])=NC=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC1=C(Br)C=NC2=NN(CC(C)(N)C#N)N=C12.FC(F)(F)C1=CC=C(C(=S)Cl)C=C1 .",
"input": "",
"output": " CC1=C(Br)C=NC2=NN(CC(C)(C#N)NC(=S)C3=CC=C(C(F)(F)F)C=C3)N=C12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: BrCC#CC1=CC=CC=C1.C1CCOC1.C1CNCCN1 .",
"input": "",
"output": " C(#CC1=CC=CC=C1)CN1CCNCC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)S(=O)(=O)Cl.NC1=CC=C(F)C(F)=C1NC1=CC=C(I)C=C1F Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CC(C)S(=O)(=O)NC1=CC=C(F)C(F)=C1NC1=CC=C(I)C=C1F .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC1(C)OB(C2=CC(Cl)=CC(N)=C2F)OC1(C)C.COCCOC.C[Si](C)(C)CCOCN1C(C2CC2)=NC(Br)=C1C1=CC=NC(NCCC#N)=N1.O=C([O-])[O-].[Na+] ",
"input": "",
"output": " C[Si](C)(C)CCOCN1C(C2CC2)=NC(C2=CC(Cl)=CC(N)=C2F)=C1C1=CC=NC(NCCC#N)=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CC(=O)OCC1=C(C(=O)O)N2C(=O)[C@@H](N)[C@H]2SC1.CN(C(N)=O)C1=CC=C(C(NC(=O)OC(C)(C)C)C(=O)O)C=C1.SC1=CNN=N1 as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CN(C(N)=O)C1=CC=C(C(N)C(=O)NC2C(=O)N3C(C(=O)O)=C(CSC4=CNN=N4)CS[C@H]23)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C[C@@H]1CN(C2=CC=C3C(Cl)=CC=CC3=N2)C[C@H](C)N1.O=C(NCC(F)(F)F)C1(CCCCBr)C2=CC=CC=C2OC2=CC=CC=C21 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " C[C@@H]1CN(C2=CC=C3C(Cl)=CC=CC3=N2)C[C@H](C)N1CCCCC1(C(=O)NCC(F)(F)F)C2=CC=CC=C2OC2=CC=CC=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CC=C([PH](C2=CC=CC=C2)(C2=CC=CC=C2)[Pd]([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)[PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.CC1=CC=CC=C1.CC1=NC(C(F)(F)F)=CC=C1CN1N=C2C(C3=CC=NC=C3)=C(Cl)C=CN2C1=O.N#CC1=CC=C(B(O)O)C=C1.O=C([O-])[O-].[Na+] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CC1=NC(C(F)(F)F)=CC=C1CN1N=C2C(C3=CC=NC=C3)=C(C3=CC=C(C#N)C=C3)C=CN2C1=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CI.CN(C)C=O.COC(=O)C(SC)C1=CC=C2C=C(OC)C=CC2=C1.[Cl-].[H-].[NH4+].[Na+] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: COC(=O)C(C)(SC)C1=CC=C2C=C(OC)C=CC2=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " ClC(Cl)Cl.ClCCl.NC1=NC=CC(C(F)(F)F)=N1.O=C1CCC(=O)N1Br.[Na+].[OH-] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be NC1=NC=C(Br)C(C(F)(F)F)=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC(C)(C)OC(=O)N1CC2=CN=C(C#N)N=C2C1.ClCCl.O=C(O)C(F)(F)F , what product could potentially be produced?",
"input": "",
"output": "The product can be N#CC1=NC=C2CNCC2=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CC=C(P(C2=CC=CC=C2)[C-]2C=CC=C2)C=C1.CC1(C)OB(C2=CC=C(OCC3=CC=CC=C3)C=C2)OC1(C)C.CC1(C)OC(C2=CC=C(C#N)C=C2)=C(Br)C1=O.CC1=CC=CC=C1.Cl[Pd]Cl.O.O=C([O-])[O-].[Cs+].[Fe+2] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CC1(C)OC(C2=CC=C(C#N)C=C2)=C(C2=CC=C(OCC3=CC=CC=C3)C=C2)C1=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1=CC=C(N2CCNCC2)N=C1.CCN(CC)CC.CN(C)C=O.ClCC1=NC2=CC=CC=C2N1 as the reactants and reagents.",
"input": "",
"output": " C1=CC=C(N2CCN(CC3=NC4=CC=CC=C4N3)CC2)N=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CCO.CCOC(=O)[C@H]1[C@@H](C)CC=CC12CCCC2.[K+].[Na+].[OH-] .",
"input": "",
"output": " CC1CC=CC2(CCCC2)C1C(=O)O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(N)C1=CC=CC(C(F)(F)F)=C1.O=C(O)CCSCC1=CC=CC(C(=O)NC2=CC=C(N3CCCCC3)C=C2C2=CC(C(=O)NCC3=CC=CC(C(F)(F)F)=C3)=CC=N2)=C1 Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CC(NC(=O)C1=CC=NC(C2=CC(N3CCCCC3)=CC=C2NC(=O)C2=CC=CC(CSCCC(=O)O)=C2)=C1)C1=CC=CC(C(F)(F)F)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C1=CC=NC=C1.C1CCOC1.O=C(Cl)OC1=CC=C([N+](=O)[O-])C=C1.OC1CCCCC1 as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " O=C(OC1=CC=C([N+](=O)[O-])C=C1)OC1CCCCC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.CCOCC.C[Mg]Br.O=C1C[C@@H]2[C@@H](/C=C/C(=O)C3=CC4=CC=CC=C4S3)[C@H](OC(=O)C3=CC=CC=C3)C[C@@H]2O1 Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CC(O)(/C=C/[C@@H]1[C@H]2CC(=O)O[C@H]2C[C@H]1OC(=O)C1=CC=CC=C1)C1=CC2=CC=CC=C2S1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC1=NC2=CC=CC=C2N(CC2=CC=CC=C2)C(=O)C1.COC1=CC=C(CBr)C=C1.O.[H-].[Na+] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be COC1=CC=C(CC2C(=O)N(CC3=CC=CC=C3)C3=CC=CC=C3N=C2C)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1CCOC1.CCO.COC(=O)C1=CC2=C(C=C1F)NC(=O)C2.[BH4-].[Li+] as the reactants and reagents.",
"input": "",
"output": " O=C1CC2=CC(CO)=C(F)C=C2N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C(=NC1CCCCC1)=NC1CCCCC1.CC1=CC=CC=C1.COC(=O)C1=C(C)NC(C)=C(C(=O)O)C1C1=CC=CC([N+](=O)[O-])=C1.OCC1=NC2=CC=C(CC3=NC=CN3)C=C2O1 , what product could potentially be produced?",
"input": "",
"output": "The product can be COC(=O)C1=C(C)NC(C)=C(C(=O)OCC2=NC3=CC=C(CC4=NC=CN4)C=C3O2)C1C1=CC=CC([N+](=O)[O-])=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. C1CCOC1.CC1=NN(C)C(C(=O)NC2=CC=CC(C(=O)C3=CC=C4C(=CO)C(=O)NC4=C3)=C2)=C1.CCOC(C)=O.NC1=CC=C(C(=O)O)C=C1.O=S(=O)([O-])[O-].[Na+] ",
"input": "",
"output": " CC1=NN(C)C(C(=O)NC2=CC=CC(C(=O)C3=CC=C4C(=CNC5=CC=C(C(=O)O)C=C5)C(=O)NC4=C3)=C2)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: BrCC1=CC=C(Br)C=C1.CCOC(C)=O.CN(C)C=O.O=C([O-])[O-].O=CC1=C(Cl)N=C(C2=CC=CC=C2)N1.[K+] , what product could potentially be produced?",
"input": "",
"output": "The product can be O=CC1=C(Cl)N=C(C2=CC=CC=C2)N1CC1=CC=C(Br)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCOC(=O)C1=CC=CC(N)=C1.ClC1=NC(N2C=NC3=CC=CC=C32)=C2N=CNC2=N1.[I-].[Na+] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CCOC(=O)C1=CC=CC(NC2=NC(N3C=NC4=CC=CC=C43)=C3N=CNC3=N2)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CCCCC(CCCC)(CCCCCC(=O)O)C(=O)O.[Na+].[OH-] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CCCCC(CCCCCC(=O)O)C(=O)O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCCC[N+](CCCC)(CCCC)CCCC.CO.O=[Pt].[N-]=[N+]=N[C@@H]1C(=O)N(S(=O)(=O)[O-])[C@H]1C1=CC=CC=C1 Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be N[C@@H]1C(=O)N(S(=O)(=O)O)[C@H]1C1=CC=CC=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with NC(C1=CC=CC=C1)C1=CC(F)=CC(F)=C1.O=C(O)CNC(=O)C1=CC=C(F)C=C1 as the reactants and reagents.",
"input": "",
"output": " O=C(CNC(=O)C1=CC=C(F)C=C1)NC(C1=CC=CC=C1)C1=CC(F)=CC(F)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CC(C)(C)OC(=O)N1CCC(C2CC3=CC(Cl)=NC=C3O2)CC1.CS(=O)(=O)NC1=CC=C(B(O)O)C=C1 as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CC(C)(C)OC(=O)N1CCC(C2CC3=CC(C4=CC=C(NS(C)(=O)=O)C=C4)=NC=C3O2)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1=CC=C(P(CCCCP(C2=CC=CC=C2)C2=CC=CC=C2)C2=CC=CC=C2)C=C1.CC1=CC=CC=C1.CCC1=CN=C(Cl)N=C1.CCO.CCOC(C)=O.Cl[Pd]Cl.O=C([O-])[O-].O=CC1=CC=C(B(O)O)C=C1.[Na+] ",
"input": "",
"output": " CCC1=CN=C(C2=CC=C(C=O)C=C2)N=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC(C)CN(CC(=O)O)C1=CC=C(C#N)C(C(F)(F)F)=C1.NC1=CC=C(F)C=C1 ",
"input": "",
"output": " CC(C)CN(CC(=O)NC1=CC=C(F)C=C1)C1=CC=C(C#N)C(C(F)(F)F)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC(=O)OCC(=O)Cl.CCN(C(C)C)C(C)C.ClCCl.N#CC1=CC(N)=CC(C(F)(F)F)=C1 ",
"input": "",
"output": " CC(=O)OCC(=O)NC1=CC(C#N)=CC(C(F)(F)F)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC(C)N=C=O.COC1=CC=CC2=C1N=CC1=C2N(C2CCNCC2)C(=O)N(C2=CC=CC(Cl)=C2)C1=O.Cl as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: COC1=CC=CC2=C1N=CC1=C2N(C2CCN(C(=O)NC(C)C)CC2)C(=O)N(C2=CC=CC(Cl)=C2)C1=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCO.N#CC1=CC=C(Br)C(C(Br)Br)=C1.O.O=[N+]([O-])[O-].[Ag+] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be N#CC1=CC=C(Br)C(C=O)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC1=CC=CC=C1.COC1=CC=CC=C1C1CO1.O=CC1=CC=C(O)C=C1.[Na+].[OH-] ",
"input": "",
"output": " COC1=CC=CC=C1C(O)COC1=CC=C(C=O)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: Br[Mg]C1CC1.O=CC1=CC=C(C2=CC=CC3=CC=CC=C23)N=C1 .",
"input": "",
"output": " OC(C1=CC=C(C2=CC=CC3=CC=CC=C23)N=C1)C1CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC(C)(C)C1=CC(Br)=C(N)C(Br)=C1.CCO.CCOC(C)=O.O.O=N[O-].O=S(=O)(O)O.[Na+] ",
"input": "",
"output": " CC(C)(C)C1=CC(Br)=CC(Br)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CCO.NN.O.O=C1C2=CC=CC=C2C(=O)N1CC1=NN=C2CC=C(C3=CC=CC=C3F)C3=CC(Cl)=CC=C3N21 as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " NCC1=NN=C2CC=C(C3=CC=CC=C3F)C3=CC(Cl)=CC=C3N12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C=CC1=CC(C)=CC=C1[N+](=O)[O-].CCOC(=O)CC(=O)OCC.CN(C)C=O.Cl.[H-].[Na+] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CCOC(=O)C(CCC1=CC(C)=CC=C1[N+](=O)[O-])C(=O)OCC .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(=O)O.ClCCl.NCC1=CC=CC=C1.O=C([O-])O.O=C1CC2(C1)CC(COCC1=CC=CC=C1)(COCC1=CC=CC=C1)C2.[BH3-]C#N.[Na+] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " C1=CC=C(CNC2CC3(C2)CC(COCC2=CC=CC=C2)(COCC2=CC=CC=C2)C3)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC(Cl)Cl.CCCCCCC1=CC=CC=C1.Cl[Ti](Cl)(Cl)Cl.O.O=CC(=O)C1=CC=CC=C1 ",
"input": "",
"output": " CCCCCCC1=CC=C(C(O)C(=O)C2=CC=CC=C2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CCN(CC)CC.ClCCl.N[C@H]1CCN(C(=O)C2=CC(C(F)(F)F)=CC(C(F)(F)F)=C2)[C@H](CC2=CC=CC=C2)C1.O=C(O)C1=CC=NC2=CC=CC=C12.O=C1OCCN1P(=O)(Cl)N1CCOC1=O ",
"input": "",
"output": " O=C(N[C@H]1CCN(C(=O)C2=CC(C(F)(F)F)=CC(C(F)(F)F)=C2)[C@H](CC2=CC=CC=C2)C1)C1=CC=NC2=CC=CC=C12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1CCOC1.CC(C)(CO)N1C=C([N+](=O)[O-])C=N1.CCN(CC)CC.CS(=O)(=O)Cl.O as the reactants and reagents.",
"input": "",
"output": " CC(C)(COS(C)(=O)=O)N1C=C([N+](=O)[O-])C=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1=CCCCC1.COC(=O)C1=CC(Br)=CC(N2CCCC2=O)=C1.COC(=O)C1=CC(C2=CCCCC2)=CC(N2CCCC2=O)=C1.COC(=O)C1=CC(C2CC=CCC2)=CC(N2CCCC2=O)=C1 as the reactants and reagents.",
"input": "",
"output": " COC(=O)C1=CC(C2C=CCCC2)=CC(N2CCCC2=O)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(=O)N1C2=CC=C(C3=CN(C4COC4)N=C3)C=C2NC[C@@H]1C.CCN(C(C)C)C(C)C.ClCCCl.O=C(OC(Cl)(Cl)Cl)OC(Cl)(Cl)Cl Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CC(=O)N1C2=CC=C(C3=CN(C4COC4)N=C3)C=C2N(C(=O)Cl)C[C@@H]1C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C1CCOC1.CCOC(=O)C1CN(CC2=CC=C(C3=CC4=CC(CC5=NC=CS5)=CC=C4O3)C(F)=C2)C1.Cl.O.[Li+].[OH-] , what product could potentially be produced?",
"input": "",
"output": "The product can be O=C(O)C1CN(CC2=CC=C(C3=CC4=CC(CC5=NC=CS5)=CC=C4O3)C(F)=C2)C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)(C)C1=CC=C(Br)C=C1.CC(C)(C)C1=CC=C(C2(O)CCCC2)C=C1.CCCCCC.CCOCC.O.O=C1C=CCC1.[Li]CCCC Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CC(C)(C)C1=CC=C(C2(O)C=CCC2)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC(C)(C)[Si](C)(C)Cl.CN(C)C=O.COC1=CC=C(C2CNC(=O)C2)C=C1Br.[H-].[Na+] ",
"input": "",
"output": " COC1=CC=C(C2CC(=O)N([Si](C)(C)C(C)(C)C)C2)C=C1Br ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CCOC(=O)C(CC1=CC=CC=C1)CS(=O)(=O)C1=CC=CC=N1.Cl.O as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: O=C(O)C(CC1=CC=CC=C1)CS(=O)(=O)C1=CC=CC=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. COC(=O)C1=CC=C(NC(=O)C(C)N2C=CC(C3=CC(Cl)=CC=C3C#N)=CC2=O)C=C1C.[Li+].[OH-] ",
"input": "",
"output": " CC1=CC(NC(=O)C(C)N2C=CC(C3=CC(Cl)=CC=C3C#N)=CC2=O)=CC=C1C(=O)O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C1=CC=C(P(C2=CC=CC=C2)[C-]2C=CC=C2)C=C1.CC(=O)[O-].CN(C)C=O.CN1C=C(B2OC(C)(C)C(C)(C)O2)C=N1.ClCCl.Cl[Pd]Cl.O=S(=O)(C1=CC=CC=C1)N1C=C(Br)C2=CC=C(F)C=C21.[Fe+2].[K+] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CN1C=C(C2=CN(S(=O)(=O)C3=CC=CC=C3)C3=CC(F)=CC=C23)C=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC1=NC(Cl)=C(F)C(N(C)CCC2=CC=NC=C2)=N1.CS(C)=O.NN.O .",
"input": "",
"output": " CC1=NC(NN)=C(F)C(N(C)CCC2=CC=NC=C2)=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CSCOC1=CC=C2CCN(C(=O)OC(C)(C)C)CC2=C1.ClCCl.O=S(=O)(Cl)Cl as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CC(C)(C)OC(=O)N1CCC2=CC=C(OCCl)C=C2C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCOCC.CN1CCCC1=O.COC(=O)NC1=NC2=CC=C(OCC3=C(Cl)C=CC=C3Cl)C=C2N1.NCCN1CCOCC1 Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " O=C(NCCN1CCOCC1)NC1=NC2=CC=C(OCC3=C(Cl)C=CC=C3Cl)C=C2N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CN(C)C=O.FC1=CC=C(C(CCCBr)C2=CC=C(F)C=C2)C=C1.O.O=C1NC(=O)C2=CC=CC=C12.[KH] as the reactants and reagents.",
"input": "",
"output": " O=C1C2=CC=CC=C2C(=O)N1CCCC(C1=CC=C(F)C=C1)C1=CC=C(F)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1COCCO1.CC(C)=O.CO.Cl.ClC(Cl)Cl.ClCCl.NCCN1C2=CC=C3C(=O)CCC3=C2C2=C3CCC(=O)C3=CC=C21.O=C([O-])O.[Na+] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CC(C)NCCN1C2=CC=C3C(=O)CCC3=C2C2=C3CCC(=O)C3=CC=C21 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC(O)(CC(=O)O)C1=CC=C(C2=CC=C(F)C=C2)C=C1.CC1=CC=C(S(=O)(=O)O)C=C1.CC1=CC=CC=C1 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC(=CC(=O)O)C1=CC=C(C2=CC=C(F)C=C2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1=CNC=N1.CC(C)(C)[Si](C)(C)Cl.CC1=CC=C2C(=C1)C=CC1=CC(O)=CC=C1C2C1=CNC(=O)NC1=O.CN(C)C=O as the reactants and reagents.",
"input": "",
"output": " CC1=CC=C2C(=C1)C=CC1=CC(O[Si](C)(C)C(C)(C)C)=CC=C1C2C1=CNC(=O)NC1=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC(=O)O.CC(C)(C)C1=NN=C(N)S1.CC1=C(C)C(=O)OC1=O .",
"input": "",
"output": " CC1=C(C)C(=O)N(C2=NN=C(C(C)(C)C)S2)C1=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC(C)(C)OC(=O)NCC(=O)O.CC1=CC=C(S(=O)(=O)NC2=CC(Cl)=CN=C2C(=O)C2=CC=NC(N)=C2)C=C1C(F)(F)F.CCCP(=O)=O.CCN(C(C)C)C(C)C.CCOC(C)=O.ClCCl is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC1=CC=C(S(=O)(=O)NC2=CC(Cl)=CN=C2C(=O)C2=CC=NC(NC(=O)CNC(=O)OC(C)(C)C)=C2)C=C1C(F)(F)F ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C1=NN=NN1.CC(C)(C)OO.CCCCCCN(CCCCCC)C(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CC1=CC=C(OCC2=CC=CC=C2)C=C1)NC(C)=O)C(C)C.CCN(CC)P(OC(C)(C)C)OC(C)(C)C.CO.ClCCl.[H][H].[Pd] , what product could potentially be produced?",
"input": "",
"output": "The product can be CCCCCCN(CCCCCC)C(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CC1=CC=C(OP(=O)(O)O)C=C1)NC(C)=O)C(C)C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. O=C1NC(=O)C2=C(O1)C(C1=CC=C(F)C=C1)CC2.[NH4+].[OH-] ",
"input": "",
"output": " O=C1NC2=C(CCC2C2=CC=C(F)C=C2)C(=O)N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CO.C[C@H](NC(=O)OC(C)(C)C)C1=NC2=CC=C(F)C(Br)=C2N1C1CC1.ClCCl.O=C(O)C(F)(F)F ",
"input": "",
"output": " C[C@H](N)C1=NC2=CC=C(F)C(Br)=C2N1C1CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CCO.NN.O.O=C1C2=CC=CC=C2C(=O)N1CC1=CN=C(SCC2=C(F)C=CC(F)=C2F)N1C1=CC=C(F)C=C1 , what product could potentially be produced?",
"input": "",
"output": "The product can be NCC1=CN=C(SCC2=C(F)C=CC(F)=C2F)N1C1=CC=C(F)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCC2=NCCCN2CC1.C1COCCO1.CC(=O)[O-].NCC1CCCCCC1.O=C1C2=CC=CC(I)=C2C=CN1C1CC1.[C-]#[O+].[Mo].[Pd+2] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be O=C(NCC1CCCCCC1)C1=CC=CC2=C1C=CN(C1CC1)C2=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCO.CCOC(=O)C1=CC=CC(F)=C1CBr.O.OC1=CC=CC(F)=C1.[NaH] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CCOC(=O)C1=CC=CC(F)=C1COC1=CC=CC(F)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C=O.CC(C)(C)OC(=O)N1CCNCC1.CCO.O=C1/C(=C/C2=CNC3=CC=CC=C23)OC2=CC(O)=CC=C12 as the reactants and reagents.",
"input": "",
"output": " CC(C)(C)OC(=O)N1CCN(CC2=C(O)C=CC3=C2O/C(=C\\C2=CNC4=CC=CC=C24)C3=O)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCOCC.ClCCN1CCC(CC2=CC=CC=C2)CC1.N#CCC1=CC=CC2=CC=CC=C12.O.[NH2-].[Na+] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " N#CC(CCN1CCC(CC2=CC=CC=C2)CC1)C1=CC=CC2=CC=CC=C12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.CCOCC.CN1CCC2=C3C(=CC(I)=C2)C(=O)C(C(=O)O)=CN31.NCC1=CC=C(Cl)C=C1.O=C(N1C=CN=C1)N1C=CN=C1 Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CN1CCC2=C3C(=CC(I)=C2)C(=O)C(C(=O)NCC2=CC=C(Cl)C=C2)=CN31 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. O=C(NC1=NC2=CC=CC=C2N1)C1=CC=CC=N1.O=C(NC1=NC2=CC=CC=C2N1)C1=CC=CN=C1.O=C(NC1=NC2=CC=CC=C2N1)C1=CC=CS1.O=C(NC1=NC2=CC=CC=C2N1)C1=CC=NC=C1.O=C(NNC1=NC2=CC=CC=C2N1)C1=CC=CN=C1 ",
"input": "",
"output": " O=C(NC1=NC2=CC=CC=C2N1)C1=CSC=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C1CCOC1.CC(C)C[AlH]CC(C)C.CC1(C)OC(=O)C(OC2=CC=C(F)C(F)=C2)=C1C1=CC=C(S(C)(=O)=O)C=C1 as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CC1(C)OC(O)C(OC2=CC=C(F)C(F)=C2)=C1C1=CC=C(S(C)(=O)=O)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CCN(CC)CC.CCOC(C)=O.NCC1CCCCC1.O=C(Cl)C1=CC(F)=C(F)C(F)=C1 ",
"input": "",
"output": " O=C(NCC1CCCCC1)C1=CC(F)=C(F)C(F)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CCOCC.CN(C)C=O.COC1=CC=C(Br)C=C1C(C)(C)C=O.Cl.O ",
"input": "",
"output": " COC1=CC=C(C#N)C=C1C(C)(C)C=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C1=COC(P(C2=CC=CO2)C2=CC=CO2)=C1.C=C[Sn](CCCC)(CCCC)CCCC.CN(C)C=O.O=C(/C=C/C1=CC=CC=C1)/C=C/C1=CC=CC=C1.O=[N+]([O-])C1=CC=CC([N+](=O)[O-])=C1Cl.[Cl-].[Cu]I.[Li+].[Pd] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: C=CC1=C([N+](=O)[O-])C=CC=C1[N+](=O)[O-] .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC1=CC(N)=NC(C)=C1C1=CC=CC=C1.CCOC(C)=O.O=C=NC(=O)C1=C(Cl)C=CC=C1Cl , what product could potentially be produced?",
"input": "",
"output": "The product can be CC1=CC(NC(=O)NC(=O)C2=C(Cl)C=CC=C2Cl)=NC(C)=C1C1=CC=CC=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CN(C)C=O.CN1C=C(CN)C=N1.COC1=CC=C(C(=O)O)C=C1Br.ClCCl.O=C(Cl)C(=O)Cl as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " COC1=CC=C(C(=O)NCC2=CN(C)N=C2)C=C1Br ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)(C/C=C/C(=O)O)NC(=O)OC(C)(C)C.CCN(C(C)C)C(C)C.CCN=C=NCCCN(C)C.CCOC(C)=O.CN(C)C=O.CN[C@H](CC1=CC=C2C=CC=CC2=C1)C(=O)N(C)[C@H](CC1=CC=CC=C1)C(=O)NCC(F)(F)F.Cl.ClCCl.ON1N=NC2=CC=CN=C21 Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CN(C(=O)/C=C/CC(C)(C)NC(=O)OC(C)(C)C)[C@H](CC1=CC=C2C=CC=CC2=C1)C(=O)N(C)[C@H](CC1=CC=CC=C1)C(=O)NCC(F)(F)F .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C1=CSC=C1.C1CCOC1.CCCCCCCCCCCCCCBr.[Li]CCCC , what product could potentially be produced?",
"input": "",
"output": "The product can be CCCCCCCCCCCCCCC1=CC=CS1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. COC(=O)CCC(=O)C1=CC=C(N)C=C1.O=C(Cl)C=CC1=CC=CC=C1 ",
"input": "",
"output": " O=C(O)CCC(=O)C1=CC=C(NC(=O)C=CC2=CC=CC=C2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC(=O)O.CC(=O)O[BH-](OC(C)=O)OC(C)=O.CC(Cl)Cl.CC1=CC(C)=C(C(=O)NC2=NC3=CC=CC(N)=C3S2)C(C)=C1.CCC=O.[Na+] ",
"input": "",
"output": " CCCN(CCC)C1=CC=CC2=C1SC(NC(=O)C1=C(C)C=C(C)C=C1C)=N2 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC1=CC=C(S(=O)(=O)OC[C@H]2CO2)C=C1.CN(C)C=O.O.O=C([O-])[O-].O=CC1=CC(Cl)=CC=C1O.[K+] as the reactants and reagents.",
"input": "",
"output": " O=CC1=CC(Cl)=CC=C1OC[C@H]1CO1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CCOCC.ClCCCCCCN1CCCCC1.N#CCC1=CC=CC2=CC=CC=C12.[NH2-].[Na+] ",
"input": "",
"output": " N#CC(CCCCCCN1CCCCC1)C1=CC=CC2=CC=CC=C12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC(=O)C1=CC=C(S(N)(=O)=O)C=C1.CN(C)C=O.COC1=CC(OC)=C(C2=CC3=CC=CC=C3N2C)C=C1C=O.C[O-].Cl.O.[Li+] .",
"input": "",
"output": " COC1=CC(OC)=C(C2=CC3=CC=CC=C3N2C)C=C1C=CC(=O)C1=CC=C(S(N)(=O)=O)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C1COCCO1.CC1(C)C2=CC=CC(P(C3=CC=CC=C3)C3=CC=CC=C3)=C2OC2=C(P(C3=CC=CC=C3)C3=CC=CC=C3)C=CC=C21.COC1=CC=CC(C(N)=O)=C1.O=C(/C=C/C1=CC=CC=C1)/C=C/C1=CC=CC=C1.O=C([O-])[O-].O=C1NN=C(Cl)C2=CC(Br)=CC=C12.[Cs+].[Pd] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: COC1=CC=CC(C(=O)NC2=CC=C3C(=O)NN=C(Cl)C3=C2)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C=C[C@@]12CCC3=CC(O)=CC=C3[C@H]1[C@@H](CCCCCCCl)C[C@@]1(C)[C@H]2CC[C@@H]1O.CNC.O=C([O-])[O-].[Na+] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " C=C[C@@]12CCC3=CC(O)=CC=C3[C@H]1[C@@H](CCCCCCN(C)C)C[C@@]1(C)[C@H]2CC[C@@H]1O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CCCCCCCCCCCCCCCC(=O)Cl.CCCCN(CCCC)CCCC.CCOC(=O)CNC=O.CN1C=CN=C1.ClCCl.Cl[Ti](Cl)(Cl)Cl.O , what product could potentially be produced?",
"input": "",
"output": "The product can be CCCCCCCCCCCCCCCC(=O)C(NC=O)C(=O)OCC .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC(C)(C)OC(=O)N1CCC(=C(C(=O)NN)C2=CC=CC=C2)CC1.CCN=C=NCCCN(C)C.ClCCl.O.O=C(O)C1CN(C(=O)OCC2C3=CC=CC=C3C3=CC=CC=C32)C1.ON1N=NC2=CC=CC=C21 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC(C)(C)OC(=O)N1CCC(=C(C(=O)NNC(=O)C2CN(C(=O)OCC3C4=CC=CC=C4C4=CC=CC=C43)C2)C2=CC=CC=C2)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CN(C)C=O.Cl.N#CC1(C#N)CCCC1.[Cl-].[N-]=[N+]=[N-].[NH4+].[Na+] as the reactants and reagents.",
"input": "",
"output": " N#CC1(C2=NN=NN2)CCCC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC/C=C\\CCO.O=C(Cl)OCC1=CC=CC=C1 , what product could potentially be produced?",
"input": "",
"output": "The product can be CCC=CCCOC(=O)OCC1=CC=CC=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CCO.COC(=O)[C@@H]1C[C@@H](N=[N+]=[N-])CN1C(=O)OC(C)(C)C.Cl.[Pd] as the reactants and reagents.",
"input": "",
"output": " COC(=O)[C@@H]1C[C@@H]([NH3+])CN1C(=O)OC(C)(C)C.[Cl-] ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C1CCOC1.CN1CCC2=CC(N3C[C@@H](CN=[N+]=[N-])OC3=O)=CC=C2C1.CO.[H][H].[Pd] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CN1CCC2=CC(N3C[C@H](CN)OC3=O)=CC=C2C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C1COCCO1.CC(C)(C)OC(=O)N[C@@H](CCCNC(=O)OCC1=CC=CC=C1)C(=O)N[C@@H](CCCNC(=O)OCC1=CC=CC=C1)C(=O)NCCNC(=O)OCC1=CC=CC=C1.Cl , what product could potentially be produced?",
"input": "",
"output": "The product can be N[C@@H](CCCNC(=O)OCC1=CC=CC=C1)C(=O)N[C@@H](CCCNC(=O)OCC1=CC=CC=C1)C(=O)NCCNC(=O)OCC1=CC=CC=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1=CC=C(C2=NNC=C2)C=C1.CC1=CNN=C1C1=CC=CC=C1.CN(C)C(=O)C(C)(C)Br as the reactants and reagents.",
"input": "",
"output": " CC1=CN(CC(Br)C(=O)N(C)C)N=C1C1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C1CCOC1.COC(=O)[C@H](CC1=CC(Cl)=C(OCC2=CC=CC3=C2OC(C2=CC=CC=C2)=N3)C(Cl)=C1)NC(=O)C(F)(F)F.Cl.O.[Li+].[OH-] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " N[C@@H](CC1=CC(Cl)=C(OCC2=CC=CC3=C2OC(C2=CC=CC=C2)=N3)C(Cl)=C1)C(=O)O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC(C)(C)OC(=O)N[C@@H]1CCC(C)(O)C(C)(C)C1.ClCCl.O=C(O)C(F)(F)F , what product could potentially be produced?",
"input": "",
"output": "The product can be CC1(C)C[C@H](N)CCC1(C)O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CC1=CC=CC=C1.CCO.CSC1=CC=C(B(O)O)C=C1.O.O=C([O-])[O-].O=CC1=CC=CC=C1Br.[Na+] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CSC1=CC=C(C2=CC=CC=C2C=O)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CN(C)C=O.CN(C)CCCCl.Cl.O=C([O-])[O-].O=[N+]([O-])C1=CC=C2C=NNC2=C1.[K+] ",
"input": "",
"output": " CN(C)CCCN1N=CC2=CC=C([N+](=O)[O-])C=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCN(CC)CC.CCOC(=O)C1=C(Cl)C2=CC=C(Br)C=C2S1.C[Si](C)(C)I.NCCN Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be ClC1=C(C2=NCCN2)SC2=CC(Br)=CC=C12 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC(C)(C)NC(=O)N1CCN2C(=C(C(N)=O)C(Br)=C2C2CC2)C1.CC1=CC=CC=C1.CCO.COC1=CC=C(B(O)O)C=C1.O=C([O-])[O-].[Cs+] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " COC1=CC=C(C2=C(C3CC3)N3CCN(C(=O)NC(C)(C)C)CC3=C2C(N)=O)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC(C)=O.CC1=CC=C(O)C(C(=O)NC2=CC(C3=CC=CC=C3)=CC=C2C(=O)OC(C)(C)C)=C1.CCOC(C)=O.COCCl.O.O=C([O-])[O-].[K+] , what product could potentially be produced?",
"input": "",
"output": "The product can be COCOC1=CC=C(C)C=C1C(=O)NC1=CC(C2=CC=CC=C2)=CC=C1C(=O)OC(C)(C)C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1COCCO1.CCCCC([SnH])=C(CCCC)CCCC.CCOC(C)=O.COC(=O)C1=CC=C(Br)C=C1[N+](=O)[O-].Cl[Pd](Cl)([PH](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1)[PH](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1 ",
"input": "",
"output": " C=CC1=CC=C(C(=O)OC)C([N+](=O)[O-])=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CCN(CC)CC.CS(C)=O.O=C([C@@H]1CCCN1C(=O)CC1C=CC2=CC=CC=C21)N1CCC[C@H]1CO .",
"input": "",
"output": " O=C[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)CC1C=CC2=CC=CC=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CN(C)C=O.O=C1NC(=O)C2=CC=CC=C12.O=S(=O)(OCC(F)(F)COC1CCCCO1)C(F)(F)F.[KH] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " O=C1C2=CC=CC=C2C(=O)N1CC(F)(F)COC1CCCCO1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C1CCOC1.C1CSCSC1.CCCCCC.O=C1CCC2=C1C=CC=C2C(=O)C1=CC=CC=C1.[Li]CCCC is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " O=C(C1=CC=CC=C1)C1=CC=CC2=C1CCC2(O)C1SCCCS1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CN(C)C=O.ClCCCl.N#CC1=CC=C(OCC2=CC=CC=C2)C(C(=O)O)=C1.NC1=CC=CN=C1.O.ON1N=NC2=CC=CC=C21 Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " N#CC1=CC=C(OCC2=CC=CC=C2)C(C(=O)NC2=CC=CN=C2)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CN(C)C=O.CN1C(C=O)=CC2=CC=CC=C21.C[Si](C)(C)C(F)(F)F.O=C([O-])[O-].[K+] as the reactants and reagents.",
"input": "",
"output": " CN1C(C(O)C(F)(F)F)=CC2=CC=CC=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CCCOC(=O)CC1=C2CC[C@@H](NC)CN2C2=CC=CC=C12.O=C(O)C1CC2=CC=CC=C21 .",
"input": "",
"output": " CN(C(=O)C1CC2=CC=CC=C21)[C@@H]1CCC2=C(CC(=O)O)C3=CC=CC=C3N2C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CC=C(P(C2=CC=CC=C2)C2=CC=C3C=CC=CC3=C2C2=C3C=CC=CC3=CC=C2P(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.C1CCOC1.CC(=O)C1=CC(Cl)=C2C=CC=NC2=C1OS(=O)(=O)C(F)(F)F.CC(=O)[O-].ClCCl.O=C([O-])[O-].OCC1CCCNC1.[Cs+].[Pd+2] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CC(=O)C1=CC(Cl)=C2C=CC=NC2=C1N1CCCC(CO)C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CI.CN(C)C=O.O.O=C([O-])[O-].O=C1NN(C(C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C2=CC(Cl)=NC=C12.[K+] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: COC1=NN(C(C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C2=CC(Cl)=NC=C12 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.CC(C)C1=CC(C(C)C)=C(C2=CC=CC=C2P(C2CCCCC2)C2CCCCC2)C(C(C)C)=C1.C[Si](C)(C)[N-][Si](C)(C)C.ClC1=CC(OCC2=CC=CC=C2)=CC=N1.O=C(/C=C/C1=CC=CC=C1)/C=C/C1=CC=CC=C1.[Li+].[Pd] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " NC1=CC(OCC2=CC=CC=C2)=CC=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C1CCOC1.CCCC1=C(CC2=CC=C(C3=CC=CC=C3C#N)C=C2)C(=O)N([C@H]2CC[C@H](OCC(=O)OCC)CC2)C2=NC=NN12.CO.Cl.O.[Na+].[OH-] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CCCC1=C(CC2=CC=C(C3=CC=CC=C3C#N)C=C2)C(=O)N([C@H]2CC[C@H](OCC(=O)O)CC2)C2=NC=NN12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) NC1=CC=C2OCCOC2=C1.O=S(=O)(NC1=NC2=CC=CC=C2N=C1Cl)C1=CC=C(Cl)C=C1 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: O=S(=O)(NC1=NC2=CC=CC=C2N=C1NC1=CC=C2OCCOC2=C1)C1=CC=C(Cl)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC(C)(C)OCl.CCN(CC)CC.CNC(=O)CSC.ClCCl.NC1=CC=CC=C1C(=O)C1=CC=CC=C1 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CNC(=O)C(SC)C1=CC=CC(C(=O)C2=CC=CC=C2)=C1N ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. COC1=CC(B(O)O)=CC=N1.NC(=O)C1=CC(C2=CC=C(N)N=C2[C@H](CC2=CC(F)=CC(F)=C2)NC(=O)CC2=CNC3=CC=C(F)C=C23)=CC=C1F.NC1=CC=C(Br)C(C(CC2=CC(F)=CC(F)=C2)NC(=O)CC2=CNC3=CC=C(F)C=C23)=N1 ",
"input": "",
"output": " COC1=CC(C2=CC=C(N)N=C2C(CC2=CC(F)=CC(F)=C2)NC(=O)CC2=CNC3=CC=C(F)C=C23)=CC=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1CCOC1.CC1=C(N)C=CC=C1Br.CC1=NC2=CC=CC=C2C(=O)O1.CCOC(OCC)OCC.ClCCl ",
"input": "",
"output": " CC1=C(Br)C=CC=C1N1C(C)=NC2=CC=CC=C2C1=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC(=O)O.CCN(CC)CC.COC1=CC=CC(C(=O)C2=CC=CC([N+](=O)[O-])=C2)=C1.C[C@H](N)C1=CC=CC(F)=C1.Cl.Cl[Ti](Cl)(Cl)Cl.[BH3-]C#N.[Na+] .",
"input": "",
"output": " COC1=CC=CC(C(N[C@@H](C)C2=CC=CC(F)=C2)C2=CC=CC([N+](=O)[O-])=C2)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CCO.N.N#CC1=C(N)N(C2CCCCC2)N=C1.OO ",
"input": "",
"output": " NC(=O)C1=C(N)N(C2CCCCC2)N=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C1=CC=C2C(=C1)CC1OC21.C1CCNCC1.O.[Cl-].[Na+].[OH-] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: OC1CC2=CC=CC=C2C1N1CCCCC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CCC=CC1.CC1=C(CC#N)N2C=CC=C(OCC3=CC=CC=C3)C2=N1.CN(C)C=O.[Pd] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CC1=C(CC#N)N2C=CC=C(O)C2=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.CC1CC(=O)OC(=O)C1.N#CC1=CC=C(N)C=C1Cl Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CC(CC(=O)O)CC(=O)NC1=CC=C(C#N)C(Cl)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with BrCCBr.CCN(CC)CC.CCOC(=O)CCCNCCC1COC2=CC=CC=C2C1.CO as the reactants and reagents.",
"input": "",
"output": " CCOC(=O)CCCN(CCBr)CCC1COC2=CC=CC=C2C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC(C)(C)OC(=O)NCCO.OC1=CC=C(C2=CC(O)=NO2)C=C1 ",
"input": "",
"output": " CC(C)(C)OC(=O)NCCOC1=NOC(C2=CC=C(O)C=C2)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses BrB(Br)Br.COC1=CC2=C(C3=CC=NC=C3)C(C3=CC=C(F)C=C3)=NN2C=C1.ClCCl as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: OC1=CC2=C(C3=CC=NC=C3)C(C3=CC=C(F)C=C3)=NN2C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CC1=C(C(=O)O)N2C=CSC2=N1.CC1C[C@H]2CN(C(=O)OC(C)(C)C)[C@H](CN)[C@H]2C1 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CC1=C(C(=O)NC[C@@H]2[C@H]3CC(C)C[C@H]3CN2C(=O)OC(C)(C)C)N2C=CSC2=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC(=O)OC1=CC=C2CC[C@@H]3[C@@H](C2=C1)[C@H](OC(=O)C(C)(C)C)C[C@]1(C)[C@@H](OC(=O)C(C)(C)C)CC[C@@H]31.CCOC(C)=O.CCOCC.Cl.[Al+3].[H-].[Li+] .",
"input": "",
"output": " C[C@]12C[C@@H](O)[C@@H]3C4=CC(O)=CC=C4CC[C@H]3[C@@H]1CC[C@@H]2O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CNC1=CC(F)=CC=C1C(=O)OC.CNS(C)(=O)=O.[Li]CCCC is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CNC1=CC(F)=CC=C1C(=O)CS(=O)(=O)NC ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CCO.COC(=O)C1=CC=C(CO)C=C1C1=CC=CC=C1C.[Na+].[OH-] as the reactants and reagents.",
"input": "",
"output": " CC1=CC=CC=C1C1=CC(CO)=CC=C1C(=O)O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC1=CC=CC=C1.CCOC(=O)CC(C)=O.COC(=O)C(Cl)=NO.[H-].[Na+] ",
"input": "",
"output": " CCOC(=O)C1=C(C)ON=C1C(=O)OC ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CON(C)C(=O)CF.[Li]C1=CC=CN=C1 ",
"input": "",
"output": " O=C(CF)C1=CC=CN=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using COC1=CC=C(C(C)=O)C(O)=C1.O=C(Cl)C1=CC=CC=C1Cl as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " COC1=CC=C2C(=O)C=C(C3=CC=CC=C3Cl)OC2=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CC=C(P(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.CC1=CC=CC=C1.CCO.Cl[Pd](Cl)([PH](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1)[PH](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1.O=C([O-])[O-].O=C1CC(C2=CC=CC=C2)OC2=CC(F)=C(Br)C=C12.OB(O)C1=CC=CN=C1F.[Na+] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be O=C1CC(C2=CC=CC=C2)OC2=CC(F)=C(C3=CC=CN=C3F)C=C12 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CCOCCN1C(Cl)=NC2=CC=CC=C21.CN1CCNCC1.O=C(O)/C=C/C(=O)O as the reactants and reagents.",
"input": "",
"output": " CCOCCN1C(N2CCN(C)CC2)=NC2=CC=CC=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC(C)(C)OC1=CC(C2=CNC3=NC=CC=C23)=CC(C2=CC=CC=C2)=N1.ClCCl.O=C(O)C(F)(F)F , what product could potentially be produced?",
"input": "",
"output": "The product can be O=C1C=C(C2=CNC3=NC=CC=C23)C=C(C2=CC=CC=C2)N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CC(C)(C)OC(=O)N1CCC(NS(=O)(=O)C2=CC=C(Cl)C=C2N)CC1.ClCCl.O=C([O-])[O-].O=C1NC2=CC(Cl)=CC=C2C1(Br)CC1=CC=CC(Cl)=C1.[K+] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CC(C)(C)OC(=O)N1CCC(NS(=O)(=O)C2=CC=C(Cl)C=C2NC2(CC3=CC=CC(Cl)=C3)C(=O)NC3=CC(Cl)=CC=C32)CC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C1CCOC1.NC1=CC(C(F)(F)F)=CC=C1C1=CC2=CC=CC=C2N1.O=C(O)C(F)(F)F , what product could potentially be produced?",
"input": "",
"output": "The product can be NC1=CC(C(F)(F)F)=CC=C1C1CC2=CC=CC=C2N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if ClCCl.N#CC1=CC=C(C2=C(CO)OC=N2)C=C1.O=[Mn]=O is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " N#CC1=CC=C(C2=C(C=O)OC=N2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CN(C)C=O.CN(C)CCN(C)S(=O)(=O)C1=CC=C(Cl)C([N+](=O)[O-])=C1.O=[N+]([O-])C1=CC=C(O)C=C1.[H-].[Na+] as the reactants and reagents.",
"input": "",
"output": " CN(C)CCN(C)S(=O)(=O)C1=CC=C(OC2=CC=C([N+](=O)[O-])C=C2)C([N+](=O)[O-])=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CCOC(=O)C(CC1=CC=C(OC(C)(C)C)C=C1)C(O)C1=CC=CC(Cl)=C1.CO.[Na+].[OH-] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CC(C)(C)OC1=CC=C(CC(C(=O)O)C(O)C2=CC=CC(Cl)=C2)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC(C)O.ClC1=NC=NC2=C1SC=C2.NC1=CC=C(OCC2CCCCC2)C=C1 ",
"input": "",
"output": " C1=NC(NC2=CC=C(OCC3CCCCC3)C=C2)=C2SC=CC2=N1.Cl ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CCOC(C)=O.C[C@H](/C=C\\CCO)CCCC(C)(C)O.[H][H].[Pd] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " C[C@H](CCCCO)CCCC(C)(C)O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC(C)(C#N)C1=CC=C(N)C=C1.CC(C)(C)O.CCOC(=O)C1=CN=C2C=CC(Cl)=NC2=C1Cl.CCOC(C)=O.O=C([O-])[O-].[K+] .",
"input": "",
"output": " CCOC(=O)C1=CN=C2C=CC(Cl)=NC2=C1NC1=CC=C(C(C)(C)C#N)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC1=CC=C(N)C=C1C(=O)C1=CC=C(NC2=CC=C(C(F)(F)F)C=C2)C=C1Cl.COC1=CC=CC=C1NC1=CC=C(C(=O)C2=CC([N+](=O)[O-])=CC=C2C)C(Cl)=C1 ",
"input": "",
"output": " COC1=CC=CC=C1NC1=CC=C(C(=O)C2=CC(N)=CC=C2C)C(Cl)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CCCOC(=O)CC1=C2CC[C@@H](NC)CN2C2=CC=CC=C12.O=C(O)C(C1=CC=C(F)C=C1)N1CCCCC1 ",
"input": "",
"output": " CN(C(=O)C(C1=CC=C(F)C=C1)N1CCCCC1)[C@@H]1CCC2=C(CC(=O)O)C3=CC=CC=C3N2C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC(=O)O.CC1=C2C(=CN1C)CN=C(C1=CC=CC=C1Cl)C1=CC(Cl)=CC=C12.O=S(=O)(O)O.O=S([O-])O.OO.[Na+] ",
"input": "",
"output": " CC1C2=C(CN=C(C3=CC=CC=C3Cl)C3=CC(Cl)=CC=C23)C(=O)N1C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC1=C(C(=O)OCCN2C(=O)C3=CC=CC=C3C2=O)C(C2=CC=CC=C2[N+](=O)[O-])C(C(=O)OCC(C)C)=C(C)N1.NN.O ",
"input": "",
"output": " CC1=C(C(=O)OCCN)C(C2=CC=CC=C2[N+](=O)[O-])C(C(=O)OCC(C)C)=C(C)N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CC=C(P(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.CC(C)(C)OC(=O)N=NC(=O)OC(C)(C)C.CC(C)C1=NOC(N2CCC([C@H]3C[C@H]3CCO)CC2)=N1.ClCCl.O=C(CC1=CC=C(O)C(F)=C1)N1CCC1 Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CC(C)C1=NOC(N2CCC([C@H]3C[C@H]3CCOC3=CC=C(CC(=O)N4CCC4)C=C3F)CC2)=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CCCCO.COC(OC)C(C)N.O=S(=O)(O)O.S=C1NC2=CC=CC=C2NC2=CC=CC=C12.[Na+].[OH-] ",
"input": "",
"output": " CC1=CN2C3=CC=CC=C3NC3=CC=CC=C3C2=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCO.CCOC(=O)C(C)[C@H]1CC[C@H](C2=CC=C(N=C(C3=CC=CC=C3)C3=CC=CC=C3)C=C2)CC1.[Pd] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CCOC(=O)C(C)[C@H]1CC[C@H](C2=CC=C(N)C=C2)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.CC1=CC(Br)=CC=C1C(=O)NCC(F)(F)F.CN(C)C=O.Cl.O.[Li]CCCC Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CC1=CC(C=O)=CC=C1C(=O)NCC(F)(F)F .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) Cl.N#CC1=CC=C2CNCCC2=C1.O=C(Cl)C1=CC=C(OCCCN2CCCCC2)C=C1 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: N#CC1=CC=C2CN(C(=O)C3=CC=C(OCCCN4CCCCC4)C=C3)CCC2=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)NC(=N)NC#N.CC(C)O.CN(C)S(=O)(=O)C1=CC=C(N)C=C1.Cl Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CC(C)NC(=N)NC(=N)NC1=CC=C(S(=O)(=O)N(C)C)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CCC1=CC=CC(C(=O)C2=CC=CC=C2)=C1N.COC(=O)CC(=O)Cl ",
"input": "",
"output": " CCC1=CC=CC(C(=O)C2=CC=CC=C2)=C1NC(=O)CC(=O)OC ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CO.C[C@H](CN(CC1=CC=CC=C1)C(=O)OC(C)(C)C)N1C(=O)C2=CC=CC=C2C1=O.NN.O ",
"input": "",
"output": " C[C@@H](N)CN(CC1=CC=CC=C1)C(=O)OC(C)(C)C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC1=CC=CC=C1.CCOC(=O)C1=CC=C(N2CCNC(C)(C)C2)S1.CCOC(C)=O.COC1=CC(COC2=NNC(N)=C2)=CC(OC)=C1.C[Al](C)C.Cl.O.O=C([O-])C(O)C(O)C(=O)[O-].[K+].[Na+] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " COC1=CC(COC2=NNC(NC(=O)C3=CC=C(N4CCNC(C)(C)C4)S3)=C2)=CC(OC)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CS(C)=O.ClCCCl.O.O=C(NC(CC1=CC=CC=C1)C(O)C(=O)NCCC1=CC=CC=C1)C1=CC=CN=C1N1C=CC(C2=CC=C(F)C=C2)=N1.O=C(O)C(Cl)Cl.O=C([O-])O.[Cl-].[Na+] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be O=C(NCCC1=CC=CC=C1)C(=O)C(CC1=CC=CC=C1)NC(=O)C1=CC=CN=C1N1C=CC(C2=CC=C(F)C=C2)=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC(C)O.Cl.ClC1=CC(Cl)=NC=N1.NC1=CC=C(Cl)C=C1 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: ClC1=CC=C(NC2=CC(Cl)=NC=N2)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC1=C(C2=CC=CC=C2)N(C2=CC=CC(S(C)=O)=C2)C(C2=CC=CC=C2)=CC1=O.CO.O.O=S([O-])OO.[K+] ",
"input": "",
"output": " CC1=C(C2=CC=CC=C2)N(C2=CC=CC(S(C)(=O)=O)=C2)C(C2=CC=CC=C2)=CC1=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C1=CC=C(P(C2=CC=CC=C2)[C-]2C=CC=C2)C=C1.CC#N.CC(=O)[O-].C[C@@H]1CN(C2=CC=C(NC3=CC(B4OC(C)(C)C(C)(C)O4)=CN(C)C3=O)N=C2)[C@@H](C)CN1C1COC1.Cl[Pd]Cl.O.O=CC1=C(Cl)C=CN=C1N1CCN2C(=CC3=C2CCCC3)C1=O.O=P([O-])([O-])[O-].[Fe+2].[K+].[Na+] , what product could potentially be produced?",
"input": "",
"output": "The product can be C[C@@H]1CN(C2=CC=C(NC3=CC(C4=CC=NC(N5C=CN6C7=C(C=C6C5=O)CCCC7)=C4C=O)=CN(C)C3=O)N=C2)[C@@H](C)CN1C1COC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CCC(C)=O.COC1=CC2=C(C=C1OC)N(CCCl)C=C2C1=CC2=CC=CN=C2N1S(=O)(=O)C1=CC=C(C)C=C1.[I-].[Na+] as the reactants and reagents.",
"input": "",
"output": " COC1=CC2=C(C=C1OC)N(CCI)C=C2C1=CC2=CC=CN=C2N1S(=O)(=O)C1=CC=C(C)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)[C@H](NC(=O)OCC1=CC=CC=C1)C(=O)O.CCO.COC1=CC=C(COC(=O)C2=CC=C(O)C=C2)C=C1.ClCCl Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be COC1=CC=C(COC(=O)C2=CC=C(OC(=O)[C@@H](NC(=O)OCC3=CC=CC=C3)C(C)C)C=C2)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. COC1=CC=C(CN(CC2=CC=C(OC)C=C2)C2=NC=C(B3OC(C)(C)C(C)(C)O3)C(C)=N2)C=C1.COC1=CC=C(CN(CC2=CC=C(OC)C=C2)C2=NC=C(B3OC(C)(C)C(C)(C)O3)C=N2)C=C1.ClC1=NC(N2CCOCC2)=NC2=C1CCN2C1=CC=NC=C1 ",
"input": "",
"output": " CC1=NC(N)=NC=C1C1=NC(N2CCOCC2)=NC2=C1CCN2C1=CC=NC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC1=CC=C(C#N)C(Cl)=C1.CC1=CC=CC=C1.CCOCC.Cl.[MgH]CBr.[Na+].[OH-] ",
"input": "",
"output": " CC(=O)C1=CC=C(C)C=C1Cl ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.CCCCCC.CC[Si](CC)(CC)OC1CN(S(=O)(=O)C2CC2)C1.CI.[Li]CCCC Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CC[Si](CC)(CC)OC1CN(S(=O)(=O)C2(C)CC2)C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)(C)OC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)O.NCC1=CC=CC=C1 Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CC(C)(C)OC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NCC1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C1CCOC1.CCOC(=O)C1=CC(N2C(S(C)(=O)=O)=NC(C(F)(F)F)=CC2=O)=CC=C1Cl.N , what product could potentially be produced?",
"input": "",
"output": "The product can be CCOC(=O)C1=CC(N2C(N)=NC(C(F)(F)F)=CC2=O)=CC=C1Cl .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CCOC(=O)CCC(CCCCN(C(=O)OC(C)(C)C)S(=O)(=O)C1=CC=C(Cl)C=C1)CCOC1=CC=CN=C1.O=C(O)C(F)(F)F as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CCOC(=O)CCC(CCCCNS(=O)(=O)C1=CC=C(Cl)C=C1)CCOC1=CC=CN=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC1=CC(C2=CC=CC(C(=O)CC(=O)OC(C)(C)C)=C2)=CC=N1.CC1=CC=CC=C1.ClCCl.NC1=CC(C(F)(F)F)=C(C(F)(F)F)C=C1N.O=C(O)C(F)(F)F ",
"input": "",
"output": " CC1=CC(C2=CC=CC(C3=NC4=CC(C(F)(F)F)=C(C(F)(F)F)C=C4NC(=O)C3)=C2)=CC=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC1=C(C(=O)O)C2=CC(Cl)=CC=C2NC1=O.O=S(Cl)Cl is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC1=C(C(=O)Cl)C2=CC(Cl)=CC=C2NC1=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CCCN(C(=O)NCCN(C)C)C(=O)[C@@H]1C[C@@H]2CC3=C(C[C@H]2N(C)C1)SC(N)=C3C#N.CN(C)C1=CC=NC=C1.CO.ClCCl.O=C(N1C=CN=C1)N1C=CN=C1 .",
"input": "",
"output": " CCCN(C(=O)NCCN(C)C)C(=O)[C@@H]1C[C@@H]2CC3=C(C[C@H]2N(C)C1)SC(NC(=O)OC)=C3C#N ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC1=CC=C(S(=O)(=O)O)C=C1.CO.O=CC1=CC=CC(OCCO)=C1 ",
"input": "",
"output": " COC(OC)C1=CC=CC(OCCO)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CC1=NNC2=NC=NC(N)=C12.CN(C)C=O.COC1=C(C(C)Cl)C=C(Cl)C(F)=C1C1CN(C(=O)OC(C)(C)C)C1.[H-].[Na+] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " COC1=C(C(C)N2N=C(C)C3=C(N)N=CN=C32)C=C(Cl)C(F)=C1C1CN(C(=O)OC(C)(C)C)C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C1COCCO1.CCN(CC)CC.CS(=O)(=O)Cl.O.O=C1C(C2=CC=CC=C2)=CNN1C1=CC=CC=N1 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CS(=O)(=O)N1C=C(C2=CC=CC=C2)C(=O)N1C1=CC=CC=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: COC1=CC=C(CNCC2=NC=C(C3=CC=NC(C)=C3)C=C2C)C(OC)=C1.O=C(O)C(F)(F)F , what product could potentially be produced?",
"input": "",
"output": "The product can be CC1=CC(C2=CN=C(CN)C(C)=C2)=CC=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.CCOC(C)=O.CNC.OCCCCCCCCCCCCBr Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CN(C)CCCCCCCCCCCCO .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC#N.CCN(CC)CC.Cl.NCC1=CC=CC(I)=C1.NS(=O)(=O)C1=CC=C(N=C=S)C=C1 Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be NS(=O)(=O)C1=CC=C(NC(=S)NCC2=CC=CC(I)=C2)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) COC(=O)C1=CC=C2C(=O)C3=CC(Br)=CC=C3OC2=C1.COC(=O)C1=CC=C2C(=O)C3=CC=CC=C3OC2=C1 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: O=C(O)C1=CC=C2C(=O)C3=CC(Br)=CC=C3OC2=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: COC(=O)OC.C[O-].O[C@@H]1CCCC[C@H]1O.[Na+] , what product could potentially be produced?",
"input": "",
"output": "The product can be O=C1OC2CCCCC2O1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CCN=C=NCCCN(C)C.NC1CN(C2CCC(C3=NOC(C(Cl)(Cl)Cl)=N3)CC2)C1.O=C(O)CNC(=O)C1=CC=CC(C(F)(F)F)=C1 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: O=C(CNC(=O)C1=CC=CC(C(F)(F)F)=C1)NC1CN(C2CCC(C3=NOC(C(Cl)(Cl)Cl)=N3)CC2)C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.CC1=NN(C)C(C(=O)NC2=CC=CC(C(=O)C3=CC=C4C(=CO)C(=O)NC4=C3)=C2)=C1.CCOC(C)=O.NC1=CC=C(N2CCC(O)CC2)C=C1 Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CC1=NN(C)C(C(=O)NC2=CC=CC(C(=O)C3=CC=C4C(=CNC5=CC=C(N6CCC(O)CC6)C=C5)C(=O)NC4=C3)=C2)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CCOC=C(C(=O)OCC)C(=O)OCC.FC1=CC(NC2CCCC2)=CC(F)=C1F as the reactants and reagents.",
"input": "",
"output": " CCOC(=O)C(=CN(C1=CC(F)=C(F)C(F)=C1)C1CCCC1)C(=O)OCC ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC(=O)C1=CC(Cl)=CC=C1O.CC(=O)O.CO.NNC(=O)C1=CC=CC(S(=O)(=O)N2CCCC2)=C1 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: C/C(=N\\NC(=O)C1=CC=CC(S(=O)(=O)N2CCCC2)=C1)C1=CC(Cl)=CC=C1O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CCCC1=C(OCCCI)C=CC2=C1OC(CCC(=O)OC)CC2.CCCCCC.CCOC(C)=O.NC(=O)C1=CC=C(O)C(CC2CC2)=C1O ",
"input": "",
"output": " CCCC1=C(OCCCOC2=CC=C(C(N)=O)C(O)=C2CC2CC2)C=CC2=C1OC(CCC(=O)OC)CC2 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: Br.CC(=O)O.COC1=NN=C2C(NC(C)C)=NC3=CC(CN4CCN(C)CC4)=CC=C3N12 .",
"input": "",
"output": " CC(C)NC1=NC2=CC(CN3CCN(C)CC3)=CC=C2N2C(=O)NN=C12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC1=CC=C(O)C=C1C.CCOC(=O)C(C)Br.CN(C)C=O.O=C([O-])[O-].[Cs+] ",
"input": "",
"output": " CCOC(=O)C(C)OC1=CC=C(C)C(C)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CC=[NH+]C=C1.O=C(Cl)C(F)(F)F.O=C([O-])C(F)(F)F.OCC(F)(F)F Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " O=C(OCC(F)(F)F)C(F)(F)F ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCOC(=O)C1=CC2=CC(F)=CC=C2N1C.CCOC(=O)C1=CC2=CC=CC=C2N1C Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CNC(=O)C1=CC2=CC(F)=CC=C2N1C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CO.NC(=O)C1=CC=CC(CC2CCC=C2C2=NC(C3=CC=CC=C3)=C(C3=CC=CC=C3)O2)=C1.[Pd] ",
"input": "",
"output": " NC(=O)C1=CC=CC(CC2CCCC2C2=NC(C3=CC=CC=C3)=C(C3=CC=CC=C3)O2)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CCCCC1=CC(C(N)=O)=NN1C(C)(C)C.CCN(CC)CC.ClCCl.O=C(OC(=O)C(F)(F)F)C(F)(F)F as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CCCCC1=CC(C#N)=NN1C(C)(C)C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C1CCOC1.Cl.O=CCC1(C(=O)OCC2=CC=CC=C2)CCCC1.O=[Ag].[Na+].[OH-] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: O=C(O)CC1(C(=O)OCC2=CC=CC=C2)CCCC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CNC(=O)C1=CC(OC2=CC=C(N)C(N)=C2)=CC=N1.O=CC1=NNC2=CC=C(F)C=C12 ",
"input": "",
"output": " CNC(=O)C1=CC(OC2=CC=C3NC(C4=NNC5=CC=C(F)C=C45)=NC3=C2)=CC=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CO.COC(=O)C=P(C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1.O=CC1=C2SC=CN2C=N1 ",
"input": "",
"output": " CC(=O)/C=C/C1=C2SC=CN2C=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C(=NC1CCCCC1)=NC1CCCCC1.C1CCOC1.O=C(O)C(C1=CC=CC=C1)N1CCCC1=O.ON1N=NC2=CC=CC=C21.O[C@H]1CN2CCC1CC2 as the reactants and reagents.",
"input": "",
"output": " O=C(O[C@H]1CN2CCC1CC2)C(C1=CC=CC=C1)N1CCCC1=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CCO.CN(C(=O)OCC1=CC=CC=C1)C(C#N)C1CCC(CO)C1.NO ",
"input": "",
"output": " CN(C(=O)OCC1=CC=CC=C1)C(C(N)=NO)C1CCC(CO)C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C1COCCO1.CC(C)C1=CC(C(C)C)=C(C2=CC=CC=C2P(C2CCCCC2)C2CCCCC2)C(C(C)C)=C1.CC1CCCN1C1=CC=CC(NC2=CC(Cl)=NN3C=CN=C23)=N1.O.O=C(/C=C/C1=CC=CC=C1)/C=C/C1=CC=CC=C1.O=C([O-])[O-].OB(O)C1=CC=C(O)C=C1.[Na+].[Pd] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CC1CCCN1C1=CC=CC(NC2=CC(C3=CC=C(O)C=C3)=NN3C=CN=C23)=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC(C)(C)OC(=O)NC1=CC=C(C#CC2=CC=CC=C2)C=C1NC(=O)CC(=O)C1=CC=CC(I)=C1.ClCCl.O=C(O)C(F)(F)F is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " O=C1CC(C2=CC=CC(I)=C2)=NC2=CC=C(C#CC3=CC=CC=C3)C=C2N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CCOCC.COC1=CC=CC(C2=CC=CC(OC3=NC(OC)=CC(OC)=N3)=C2C(=O)OCC2=CC=CC=C2)=N1.[H][H].[Pd] ",
"input": "",
"output": " COC1=CC=CC(C2=CC=CC(OC3=NC(OC)=CC(OC)=N3)=C2C(=O)O)=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CCOC(=O)C1=C(N)SC2=CC(OC)=CC=C12.CS(C)=O.O=[N+]([O-])C1=CC=C(F)C=C1F ",
"input": "",
"output": " CCOC(=O)C1=C(NC2=CC(F)=CC=C2[N+](=O)[O-])SC2=CC(OC)=CC=C12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1CCOC1.O=C1CCCC2=NC3=CC(Cl)=CC=C3C(NCC3=CC=CC=C3)=C12.[Al+3].[H-].[Li+] ",
"input": "",
"output": " OC1CCCC2=NC3=CC(Cl)=CC=C3C(NCC3=CC=CC=C3)=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CCOC(=O)C1=CC=CC=C1CCl.CN(C)C=O.O=[N+]([O-])C1=CC=C2NCCOC2=C1.[H-].[Na+] ",
"input": "",
"output": " CCOC(=O)C1=CC=CC=C1CN1CCOC2=CC([N+](=O)[O-])=CC=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H](C)N1CCNC(=O)[C@@H]1CCCCN1C1=NC2=CC=CC=C2O1.ClCCl.O=C(O)C(F)(F)F as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: C[C@@H]1CNC[C@H](C)N1CCNC(=O)[C@@H]1CCCCN1C1=NC2=CC=CC=C2O1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " NC1=CC(F)=C(OC2=CC=NC3=C2C=CN3)C(F)=C1.NC1=NC(Cl)=CC(C2=CC=NC=C2)=N1 Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be NC1=NC(NC2=CC(F)=C(OC3=CC=NC4=C3C=CN4)C(F)=C2)=CC(C2=CC=NC=C2)=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C=CCNC1=CC=CC=C1C.N[C@H]1CC=CCN(C2=CC=CC=C2)C1=O.O=C(O)C(F)(F)F Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CC1=CC=CC=C1N1CC=CC[C@H](N)C1=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C1CCOC1.COCC(=O)Cl.NC1CCN(CC2=CC=C([C@H]3COC4=CC=CN=C4O3)C=C2)CC1 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: COCC(=O)NC1CCN(CC2=CC=C([C@H]3COC4=CC=CN=C4O3)C=C2)CC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CC=NC=C1.CN(CCCN)C1=CC=CC=N1.CSC1=NC=C(CC2=CC=C(F)C=C2)C(=O)N1 Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CN(CCCNC1=NC=C(CC2=CC=C(F)C=C2)C(=O)N1)C1=CC=CC=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C#CCNC(=O)C1=CC=CC(S(=O)(=O)OC[C@@](C)(O)C(=O)[C@H](CC(C)C)NC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC2=CC=CC=C2)NC(=O)CN2CCOCC2)=C1.C#CCOC1=CC(OC)=CC(OC)=C1S(=O)(=O)Cl.CC(C)C[C@H](NC(=O)[C@H](CCC1=CC=CC=C1)NC(=O)CN1CCOCC1)C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CC(C)C)C(=O)[C@](C)(O)CO Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be C#CCOC1=CC(OC)=CC(OC)=C1S(=O)(=O)OCC(C)(O)C(=O)[C@H](CC(C)C)NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC1=CC=CC=C1)NC(=O)CN1CCOCC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC([O-])=S.CN1CCCC1=O.FC(F)(F)CCBr.[K+] as the reactants and reagents.",
"input": "",
"output": " CC(=S)OCCC(F)(F)F ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CCOCC1=NC2=CN=C3C=CC=CC3=C2N1CC1(O)CCOCC1.CO.ClC(Cl)Cl.ClCCl.O=C(OO)C1=CC=CC(Cl)=C1.O=C=NC(=O)C(Cl)(Cl)Cl as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CCOCC1=NC2=C(N)N=C3C=CC=CC3=C2N1CC1(O)CCOCC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " N#CBr.N[C@H](CO)CCOC1=CC=C(C(F)(F)F)C=N1 Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be NC1=N[C@@H](CCOC2=CC=C(C(F)(F)F)C=N2)CO1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C1CCOC1.CC(C)N=C=NC(C)C.CCOC(=O)CC(=O)O.CCOC(C)=O.NC1=NOC(C2=CC=C(F)C=C2)=C1 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CCOC(=O)CC(=O)NC1=NOC(C2=CC=C(F)C=C2)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC(=O)O.CC(=O)O[BH-](OC(C)=O)OC(C)=O.CC(Cl)Cl.COC1=CC=C2NCCC(=O)N(C3CC3)CC2=C1.O=C([O-])O.O=CCC1=CC=C(Cl)C=C1.[Na+] ",
"input": "",
"output": " COC1=CC=C2C(=C1)CN(C1CC1)C(=O)CCN2CCC1=CC=C(Cl)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. O=C(O)C(=O)C1=C(CO)N(CC2=CC=CC=C2)C2=CC=C(Br)C=C12.OB(O)C1=CC=C(C2=CC=CC=C2)C=C1.[KH] ",
"input": "",
"output": " O=C1OCC2=C(C1=O)C1=CC(C3=CC=C(C4=CC=CC=C4)C=C3)=CC=C1N2CC1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.COC(=O)Cl.COC(=O)[C@@H]1CCC(=O)N1.C[Si](C)(C)[N-][Si](C)(C)C.[Li+] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be COC(=O)[C@@H]1CCC(=O)N1C(=O)OC .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. C1CCOC1.CC(C)NC(C)C.CC1=CC(C(C)(C)C)=CC=C1C(=O)O.COC(=O)OC.[Li]CCCC ",
"input": "",
"output": " CC(C)(C)C1=CC=C(C(=O)O)C(CC(=O)O)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC1=CC=CC=C1C(CC(=O)C1=CN(C)C(=O)C=C1)C1=CC=C(C(=O)N2CCOCC2)C=C1.Cl.NO.O=C([O-])O.[Na+] , what product could potentially be produced?",
"input": "",
"output": "The product can be CC1=CC=CC=C1C(C/C(=N\\O)C1=CN(C)C(=O)C=C1)C1=CC=C(C(=O)N2CCOCC2)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(=O)OC(C)=O.CCN(CC)CC.ClCCl.O.OC1=CC=CC(C2=CC=C(OC[C@H](O)CCC3=CC=CN=C3)C=C2)=C1 Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CC(=O)OC1=CC=CC(C2=CC=C(OC[C@H](O)CCC3=CC=CN=C3)C=C2)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C#CC1=CC=CC=C1.C1=CC=C(P(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.CCN(CC)CC.COC1=CC=CC([C@H]2OC(=O)N[C@@H]2C2=CC=CC(Br)=C2)=C1.Cl[Pd](Cl)([PH](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1)[PH](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1.[Cu]I as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: COC1=CC=CC([C@H]2OC(=O)N[C@@H]2C2=CC=CC(C#CC3=CC=CC=C3)=C2)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCNCC1.CC/C(=C(\\C1=CC=C(/C=C/C(=O)O)C=C1)C1=CC=C(OC(=O)CCl)C=C1)C1=CC=CC=C1 Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CC/C(=C(\\C1=CC=C(/C=C/C(=O)O)C=C1)C1=CC=C(OC(=O)CN2CCCCC2)C=C1)C1=CC=CC=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1CCOC1.COC(=O)[C@@H](O)COCCO[Si](C1=CC=CC=C1)(C1=CC=CC=C1)C(C)(C)C.ClC1=CC=CN=C1N1N=CC2=C(Cl)N=CN=C21.[H-].[Na+] as the reactants and reagents.",
"input": "",
"output": " COC(=O)[C@H](COCCO[Si](C1=CC=CC=C1)(C1=CC=CC=C1)C(C)(C)C)OC1=NC=NC2=C1C=NN2C1=NC=CC=C1Cl ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C#CC1=CSC(C2=CC(O[C@@H]3CCN4C(=O)N(C)CCCCC=C[C@@H]5C[C@@]5(C(=O)O)NC(=O)[C@@H]4C3)=C3C=CC(OC)=C(C)C3=N2)=N1.COC(=O)[C@@]12C[C@H]1C=CCCCCN(C)C(=O)N1CC[C@H](OC3=CC(C4=NC(C)=CS4)=NC(C4=NC(C(F)(F)F)=CS4)=N3)C[C@H]1C(=O)N2 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC1=CSC(C2=CC(O[C@H]3CCN4C(=O)N(C)CCCCC=C[C@@H]5C[C@@]5(C(=O)O)NC(=O)[C@@H]4C3)=NC(C3=NC(C(F)(F)F)=CS3)=N2)=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: BrCC1CC1.CCOC(C)=O.CN(C)C=O.COC(=O)C1=CC=CNC1=O.[H-].[Li+] .",
"input": "",
"output": " COC(=O)C1=NC=CN(CC2CC2)C1=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(=O)[O-].CC1(C)CN(CC2=CC=CC=C2)CCC1=O.CN(C)C=O.ClCCl.O=P(Cl)(Cl)Cl.[Na+] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CC1(C)CN(CC2=CC=CC=C2)CC(C=O)=C1Cl .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC1=CC=CC=C1.CCOC(C)=O.COC(=O)C1=CC(NC(=O)C2=CC=CC=C2)=CC=C1OC.COC1=CC=C(P2(=S)SP(=S)(C3=CC=C(OC)C=C3)S2)C=C1 ",
"input": "",
"output": " COC(=O)C1=CC(NC(=S)C2=CC=CC=C2)=CC=C1OC ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using COC(=O)C1=CC=CC(Br)=C1.NC1=CC=C(C(F)(F)F)C=C1 as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " COC(=O)C1=CC=CC(NC2=CC=C(C(F)(F)F)C=C2)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC#N.C[C@@H](CO[Si](C)(C)C(C)(C)C)N1C=CC2=CN=CN=C21.O=C1CCC(=O)N1I.O=S([O-])([O-])=S.[Na+] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " C[C@@H](CO[Si](C)(C)C(C)(C)C)N1C=C(I)C2=CN=CN=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CNC(=O)C1=CC=CC(F)=C1NC1=NC(Cl)=NC=C1Cl.NC1=CC=C2CCC(NCC(F)F)CCC2=C1 ",
"input": "",
"output": " CNC(=O)C1=CC=CC(F)=C1NC1=NC(NC2=CC=C3CCC(NCC(F)F)CCC3=C2)=NC=C1Cl ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC(C)(C)OC(=O)C/C(=C\\CCC1=CC=CC=C1)C(=O)O.CO.NC1CCCCC1 ",
"input": "",
"output": " CC(C)(C)OC(=O)C[C@@H](CCCC1=CC=CC=C1)C(=O)O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC(C)(C)C(=O)NC1=NC2=C(CC(=O)CC2)C(NC(=O)C(C)(C)C)=N1.CCO.NOC1=CC(Cl)=CC(Cl)=C1 ",
"input": "",
"output": " CC(C)(C)C(=O)NC1=NC2=C(CC(=NOC3=CC(Cl)=CC(Cl)=C3)CC2)C(NC(=O)C(C)(C)C)=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CCOC(C)=O.CO.COC1=CC=CC2=C1COC2=O.C[O-].O=CC1=C(Cl)C=CC=C1Cl.[Na+] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: COC1=CC=CC2=C1C(=O)C(C1=C(Cl)C=CC=C1Cl)C2=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(=O)O.NN=CC1=CC=C(CCCCC(=O)NC(CC(=O)O)CS(=O)C2=CC=CC=C2)C=C1.O.OO Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " NN=CC1=CC=C(CCCCC(=O)NC(CC(=O)O)CS(=O)(=O)C2=CC=CC=C2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC1=CN(C2=CC=CC3=NC=CC=C23)C=C1C(=O)Cl.CO.C[O-].Cl.N=C(N)N.[Na+] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CC1=CN(C2=CC=CC3=NC=CC=C23)C=C1C(=O)NC(=N)N ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC(C)(C)OC(=O)N1CCN2C[C@H](CNC3=NC4=NC(C5=CC=CO5)=NN4C(N)=N3)CC[C@@H]2C1.ClC1=NC=CC=N1.ClCCl.O=C(O)C(F)(F)F.O=C([O-])[O-].[Na+] ",
"input": "",
"output": " NC1=NC(NCC2CCC3CN(C4=NC=CC=N4)CCN3C2)=NC2=NC(C3=CC=CO3)=NN12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CCC1=NC2=CC=NN2C(Cl)=C1.CCO.N#CC(C1=CC=CC=C1)C1=CC=C(N)C=C1 as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CCC1=NC2=CC=NN2C(NC2=CC=C(C(C#N)C3=CC=CC=C3)C=C2)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CC(C)(C)OC(=O)N1CCOC2=C(Br)C=CC=C2C1.CC(C)(C)[O-].CC1=CC=CC=C1.Cl.FC1(F)CCNC1.O.O=C(/C=C/C1=CC=CC=C1)/C=C/C1=CC=CC=C1.[Na+].[Pd] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CC(C)(C)OC(=O)N1CCOC2=C(C=CC=C2N2CCC(F)(F)C2)C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1COCCO1.C[C@H]1CC[C@H](CN2C(Br)=NC3=CC(C#N)=NC(C4=CN=CC(Cl)=C4)=C32)CC1.NC1=CC=CC=C1F.O=C([O-])[O-].[Cs+] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " C[C@H]1CC[C@H](CN2C(NC3=CC=CC=C3F)=NC3=CC(C#N)=NC(C4=CN=CC(Cl)=C4)=C32)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C1CCOC1.COC1=CC(C2=CC=CC(C(F)(F)F)=C2)=CC(C)=C1I.O=C=O.[Li]CCCC as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: COC1=CC(C2=CC=CC(C(F)(F)F)=C2)=CC(C)=C1C(=O)O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CCN(CC)CC.CO.COC1=CC(N)=CC=C1N1C=NC(C)=C1.COC1=NC(Cl)=NC(Cl)=N1 , what product could potentially be produced?",
"input": "",
"output": "The product can be COC1=NC(Cl)=NC(NC2=CC=C(N3C=NC(C)=C3)C(OC)=C2)=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC(C)C1=CC=C2C(NC3=CC(C4=NC5=CC=C(Br)C=C5N4)=CC=C3OC3=CC=C(OCC4=CC=CC=C4)C=C3)=NC=NC2=N1.CC1=CC(C)=C(C)C(C)=C1C.O=C(O)C(F)(F)F is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC(C)C1=CC=C2C(NC3=CC(C4=NC5=CC=C(Br)C=C5N4)=CC=C3OC3=CC=C(O)C=C3)=NC=NC2=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CC=C([PH](C2=CC=CC=C2)(C2=CC=CC=C2)[Pd]([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)[PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.COC(=O)C1=NC(N[C@@H]2C3=CC=CC=C3C[C@@H]2O)=CN=C1Br.OB(O)C1=CC=C(Cl)C=C1Cl Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be COC(=O)C1=NC(N[C@@H]2C3=CC=CC=C3C[C@@H]2O)=CN=C1C1=CC=C(Cl)C=C1Cl .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CCN(CC)CC.CCOC(=O)C(CC1=CC=C(NC(=O)OC(C)(C)C)N=C1)=C(C)CC.CCOC(C)=O.O=C(O)CC1=CC=CS1 ",
"input": "",
"output": " CCOC(=O)C(CC1=CC=C(NC(=O)OC(C)(C)C)N=C1)C(C)SC(C)=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CN(C(=O)[C@@H](CC1=CC=C2C=CC=CC2=C1)N(C)C(=O)OC(C)(C)C)[C@H](CC1=CC=CS1)CN(C)S(C)(=O)=O.ClCCl.O.O=C(O)C(F)(F)F.O=C([O-])O.[Na+] ",
"input": "",
"output": " CN[C@H](CC1=CC=C2C=CC=CC2=C1)C(=O)N(C)[C@H](CC1=CC=CS1)CN(C)S(C)(=O)=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with COC1=CC(C)=CC(C2=NN(CC#N)C=C2C2=CC=C(C3=CC=CC=C3C(C)=O)N=C2)=C1.CSC.ClCCl.FB(F)F as the reactants and reagents.",
"input": "",
"output": " CC(=O)C1=CC=CC=C1C1=CC=C(C2=CN(CC#N)N=C2C2=CC(C)=CC(O)=C2)C=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C1=CC=C([PH](C2=CC=CC=C2)(C2=CC=CC=C2)[Pd]([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)[PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.CCCCCC1=CC=C(OB(O)O)C=C1.COC(C)(C)C.COCCOC.O.O=CC1=C(Br)C=CC(OC(F)(F)F)=C1F.[Cs+].[F-] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CCCCCC1=CC=C(C2=CC=C(OC(F)(F)F)C(F)=C2C=O)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CO.NC(=O)C1=CC(OCCN(CC2=CC=CC=C2)CC(O)C2=CC(OCC3=CC=CC=C3)=CC(OCC3=CC=CC=C3)=C2)=CC=C1O.[H][H].[Pd] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " NC(=O)C1=CC(OCCNCC(O)C2=CC(O)=CC(O)=C2)=CC=C1O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CNCCN1.CC#N.ClCCl.O=S(Cl)Cl.OC(C1=CC=CC=C1)C1=CC=CC(C(F)(F)F)=C1 Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be FC(F)(F)C1=CC=CC(C(C2=CC=CC=C2)N2CCNCC2)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C.O.O=S(=O)(O)C1=CC=CC2=C(O)C=CC=C12.OCC(O)CCl.[Na+].[NaH].[OH-] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: O=S(=O)(O)C1=CC=C2C([Na])=CC=CC2=C1OCC(O)CO .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1CCOC1.COC(=O)C1CC(=O)N(CC2COC3=CC=CC=C3O2)C1.[Al+3].[H-].[Li+] as the reactants and reagents.",
"input": "",
"output": " OCC1CCN(CC2COC3=CC=CC=C3O2)C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC1=CC(C)=C(S(=O)(=O)N(CC2=CC=CC(OC3CCCCO3)=C2)C2=CC=C(C=CC(=O)O)C=C2)C(C)=C1.CCCP1(=O)OP(=O)(CCC)OP(=O)(CCC)O1.CCN(CC)CC.CCOC(C)=O.CN(C)C1=CC=NC=C1.ClCCl.NCCC1=CC=NC=C1.O=C([O-])O.[Na+] .",
"input": "",
"output": " CC1=CC(C)=C(S(=O)(=O)N(CC2=CC=CC(OC3CCCCO3)=C2)C2=CC=C(C=CC(=O)NCCC3=CC=NC=C3)C=C2)C(C)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CO.C[C@H](NC1=NC(NC2=NNC(C3CC3)=C2)=C(F)C=C1C#N)C1=CC=C(F)C=C1.Cl.[Pd] ",
"input": "",
"output": " C[C@H](NC1=NC(NC2=NNC(C3CC3)=C2)=C(F)C=C1CN)C1=CC=C(F)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC(=O)[O-].CC(C)C1=CC(C(C)C)=C(C2=CC=CC=C2P(C2CCCCC2)C2CCCCC2)C(C(C)C)=C1.CC1(C)CCOC2=C(Cl)C=C(C=O)C=C21.COC1CC1.F[B-](F)(F)C1CC1.O=C([O-])[O-].[K+].[Pd+2] ",
"input": "",
"output": " CC1(C)CCOC2=C(C3CC3)C=C(C=O)C=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CCC1=CC=C(CC(C)=O)C=C1.NCC(O)C1=CC=CC=C1 ",
"input": "",
"output": " CCC1=CC=C(CC(C)NCC(O)C2=CC=CC=C2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. C1CCOC1.CC(C)(C)OC(=O)N1CCC(Br)C2=NC(C3=CC=CC=C3)=C(C3=CC=CC=C3)N=C21.CCOCC.O=[N+]([O-])[O-].[Ag+].[Cl-].[NH4+] ",
"input": "",
"output": " CCC1CCNC2=NC(C3=CC=CC=C3)=C(C3=CC=CC=C3)N=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C1=CC=C(P(C2=CC=CC=C2)[C-]2C=CC=C2)C=C1.CC(C)(C)[O-].CC1=CC=C(Br)C=C1.CC1=CC=C(S(=O)(=O)OCC2CC3=CC=CC(NC4=CC=CC=C4)=C3O2)C=C1.CC1=CC=CC=C1.[Fe+2].[Na+] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CC1=CC=C(NC2=CC=CC3=C2OC(COS(=O)(=O)C2=CC=C(C)C=C2)C3)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using NCC(CC1CC1)C1=CC=C(C(F)(F)F)N=C1.O=C(O)C1=CC=CC(Cl)=C1Cl as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " O=C(NCC(CC1CC1)C1=CC=C(C(F)(F)F)N=C1)C1=CC=CC(Cl)=C1Cl ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC1=CC=CC=C1.CCN(CC)CC.CCO[PH](C)=O.O=CC1=CC=C(Br)C=C1 , what product could potentially be produced?",
"input": "",
"output": "The product can be CCOP(C)(=O)C1=CC=C(C=O)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC1=CC(C)=C(S(=O)(=O)ON)C(C)=C1.CO.NC1=CC(Br)=CC(N)=N1.O=CC1=CC=CC=C1.[K+].[OH-] .",
"input": "",
"output": " NC1=CC(Br)=CC2=NC(C3=CC=CC=C3)=NN12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)(C)N1C(=O)C(NCCCBr)=C(C2=CC=CC=C2)S1(=O)=O.Cl.O=C(O)C1=CC=C(O)C=C1 Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CC(C)(C)N1C(=O)C(NCCCOC(=O)C2=CC=C(O)C=C2)=C(C2=CC=CC=C2)S1(=O)=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " COC1=CC=C(CN(CCCN(C)C)C(=O)C2=CC=CC=C2S(=O)(=O)NC2=CC=C3C(=C2C(=O)OC(C)(C)C)OCC2CC32)C(OC)=C1.O=C(O)C(F)(F)F Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CN(C)CCCNC(=O)C1=CC=CC=C1S(=O)(=O)NC1=CC=C2C(=C1C(=O)O)OCC1CC21 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C1=CC=CC=C1.CC(C)O.CC1=CC=C(S(=O)(=O)O)C=C1.COC1=CC=C(C(O)CN2CC=C(C3=NNC(=O)CS3)CC2)C=C1.O.[Na+].[OH-] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " COC1=CC=C(C(CN2CC=C(C3=NNC(=O)CS3)CC2)OC(C)C)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1COCCO1.CCC1=C(Cl)N=C(C(=O)N[C@H]2CCN(C(=O)OC(C)(C)C)C[C@H]2Cl)N1.CCOC(=O)C1=C(C)N=C(Br)S1.Cl.O=C([O-])[O-].[Na+] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CCOC(=O)C1=C(C)N=C(N2CC[C@H](NC(=O)C3=NC(Cl)=C(CC)N3)[C@H](Cl)C2)S1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C#CCON=C(C(=O)O)C1=CSC(N)=N1.CC(=O)OC(C)=O.CC(C)OC(C)C.O=CO Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be C#CCON=C(C(=O)O)C1=CSC(NC=O)=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CCCN(C)C1=CC(NC(=O)OC(C)(C)C)=C(NC(=O)CC(=O)C2=CC=CC(N3N=CN=C3COC3CCCCO3)=C2)C=C1Cl.ClCCl.O=C(O)C(F)(F)F ",
"input": "",
"output": " CCCN(C)C1=CC2=C(C=C1Cl)NC(=O)CC(C1=CC=CC(N3N=CN=C3CO)=C1)=N2 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CCN(CC)CC.CCN1C(=O)C(C)(C)C(=O)N(C)C2=CC(CN)=CC=C21.ClCCl.O=C([O-])O.O=[N+]([O-])C1=CC=CC=C1S(=O)(=O)Cl.[Na+] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CCN1C(=O)C(C)(C)C(=O)N(C)C2=CC(CNS(=O)(=O)C3=CC=CC=C3[N+](=O)[O-])=CC=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. C1=CC=CC=C1.NCCO.O=C(O)CS.O=CC1=CC=CC(OC2=CC=CC=C2)=C1 ",
"input": "",
"output": " O=C1CSC(C2=CC=CC(OC3=CC=CC=C3)=C2)N1CCO ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C1CCOC1.CCN(CC)CC.Cl.N[C@H]1CC[C@@H](C(=O)O)CC1.O.O=C(CBr)C1=CC=C(Br)C=C1.O=C(N=C=S)C1=CC=CC=C1.[Li+].[OH-] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: O=C(O)C1CCC(NC2=NC(C3=CC=C(Br)C=C3)=CS2)CC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C=COC(C)=O.CCOC(C)=O.CO.COC1=CC(Br)=CC(N(O)C(C)=O)=C1.Cl.O.O=C([O-])[O-].[Cl-].[Na+].[OH-] , what product could potentially be produced?",
"input": "",
"output": "The product can be COC1=CC(Br)=C2C=CNC2=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1=CC=C2SC3=CC=CC=C3NC2=C1.C=C(C)C(=O)OC.CC(C)[O-].CCCCCC=C/C=C/CO.[Ti+4] as the reactants and reagents.",
"input": "",
"output": " C=C(C)C(=O)OC/C=C/C=CCCCCC ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CCO.CCOC(=O)C1=CC(NC(=O)NC2=C(C(=O)OC)CSC2)=CC=C1Cl.CC[O-].[Na+] ",
"input": "",
"output": " CCOC(=O)C1=CC(N2C(=O)NC3=C(CSC3)C2=O)=CC=C1Cl ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC1=NC=C(C=O)S1.COC(=O)C1=CC=C2C(=O)CCCC2=C1 Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be COC(=O)C1=CC=C2C(=O)C(=CC3=CN=C(C)S3)CCC2=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C1CCNCC1.Cl.ClCC1CO1.OC1=CC=CC=C1 .",
"input": "",
"output": " OC(CCl)COC1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CCOC(C)=O.CO.COCCNC1=CC=C2NC(C3=CC=C(N)C([N+](=O)[O-])=C3)=NC2=C1.[Pd] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: COCCNC1=CC=C2NC(C3=CC=C(N)C(N)=C3)=NC2=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1CCOC1.CC(C)C[Al+]CC(C)C.CON(C)C(=O)C1=CN=C(SCC2=C(F)C=CC(F)=C2F)N1C1=CC=C(F)C=C1.O=CC1=CN=C(S)N1C1=CC=C(F)C=C1.[H-] ",
"input": "",
"output": " O=CC1=CN=C(SCC2=C(F)C=CC(F)=C2F)N1C1=CC=C(F)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC(C)(C)OC(=O)N1CCCC(C2=CC=C(N)N=C2)CC1.CC1=C(Br)C(=O)N(C2CCCC2)C2=NC(S(C)=O)=NC=C12.CC1=CC=CC=C1.CCOC(C)=O.O=C1CCC(=O)O1 .",
"input": "",
"output": " CC1=C(Br)C(=O)N(C2CCCC2)C2=NC(NC3=CC=C(C4CCCN(C(=O)OC(C)(C)C)CC4)C=N3)=NC=C12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CCN(CC)CC.CCOC(C)=O.NO.O.O=C(Cl)OC1=CC=CC=C1 ",
"input": "",
"output": " O=C(NO)OC1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C1CCOC1.CC(=O)OC1=CC=CC=C1C(=O)Cl.COC(=O)CC(=O)OC.[H-].[Na+] , what product could potentially be produced?",
"input": "",
"output": "The product can be COC(=O)C(C(=O)OC)C(=O)C1=CC=CC=C1OC(C)=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC(C)C[Al+]CC(C)C.CC1=CC=CC=C1.CCOC(=O)/C=C/CCCC(C)(C)C/C=C\\C(O[Si](CC)(CC)CC)(C(F)(F)F)C(F)(F)F.[H-] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC[Si](CC)(CC)OC(/C=C\\CC(C)(C)CCC/C=C/CO)(C(F)(F)F)C(F)(F)F ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCN(CC)CC.CN(C)C1CCCCC1N.O=C(Cl)C1=CC=C(C(F)(F)F)C=C1 Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CN(C)[C@@H]1CCCC[C@H]1NC(=O)C1=CC=C(C(F)(F)F)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(=O)OC(C)=O.CCOCC.N#CNC1=CC=C(CC2=CC=C(NC#N)C=C2)C=C1 Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CC(=O)N(C#N)C1=CC=C(CC2=CC=C(N(C#N)C(C)=O)C=C2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C#CCN(C)C.C1=CC=C([PH](C2=CC=CC=C2)(C2=CC=CC=C2)[Pd]([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)[PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.C1=CC=CC=C1.CCN(CC)CC.CO.COC1=CC(NC2=C(C#N)C=NC3=C2SC(I)=C3)=C(Cl)C=C1Cl.[Cu]I , what product could potentially be produced?",
"input": "",
"output": "The product can be COC1=CC(NC2=C(C#N)C=NC3=C2SC(C#CCN(C)C)=C3)=C(Cl)C=C1Cl .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(=O)Cl.COC1=CC=C(NC(=O)C2=CC=C(N)C=C2NC(=O)C2=CC=C(C(C)(C)C)C=C2)C=C1 Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be COC1=CC=C(NC(=O)C2=CC=C(NC(C)=O)C=C2NC(=O)C2=CC=C(C(C)(C)C)C=C2)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CN(CCO)C1=CC=C(C(=O)NC2=CC=C([N+](=O)[O-])C([N+](=O)[O-])=C2)C=C1.O=CC1=CC=C(C(=O)NC2=CC=CC=C2)C=C1 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CN(CCO)C1=CC=C(C(=O)NC2=CC=C3NC(C4=CC=C(C(=O)NC5=CC=CC=C5)C=C4)=NC3=C2)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C1=CC=NC=C1.CC(C)(C)OC(=O)N1CCOC(C2=CC=C3C(N)=NNC3=C2)C1.O=C(Cl)C1=CC=C(F)C=C1 as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CC(C)(C)OC(=O)N1CCOC(C2=CC=C3C(NC(=O)C4=CC=C(F)C=C4)=NNC3=C2)C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC(=O)N1CCCC(C)(C)C2=CC=C(N)C=C21.COC1=CC(N2CCOCC2)=CC=C1NC1=NC(Cl)=NC=C1Cl as the reactants and reagents.",
"input": "",
"output": " COC1=CC(N2CCOCC2)=CC=C1NC1=NC(NC2=CC=C3C(=C2)N(C(C)=O)CCCC3(C)C)=NC=C1Cl ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C1=CC=NC=C1.CCO.CCOC(=O)C(=S)/N=C/N(C)C.NOS(=O)(=O)O as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CCOC(=O)C1=NC=NS1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. BrC1=CC=C2NC=CC2=C1.C=CS(=O)(=O)NC.CC(=O)[O-].CC(C)O.CCN(CC)CC.[Pd+2] ",
"input": "",
"output": " CNS(=O)(=O)/C=C/C1=CC=C2NC=CC2=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CCN(CC)C(=O)[C@H](C)O.CCN=C=NCCCN(C)C.CN(C)C1=CC=NC=C1.COC(=O)/C=C/C(=O)O.Cl.ClCCl ",
"input": "",
"output": " CCN(CC)C(=O)[C@H](C)OC(=O)/C=C/C(=O)OC ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC1=C(C2=CC=CC=C2)C(F)=C2OC(N(C)CC3=NC=NN3)=NC2=C1C#N.CCN(CC)CC.CN(C)[C@H]1CCNC1.CS(C)=O.ClCCl , what product could potentially be produced?",
"input": "",
"output": "The product can be CC1=C(C2=CC=CC=C2)C(N2CC[C@H](N(C)C)C2)=C2OC(N(C)CC3=NC=NN3)=NC2=C1C#N .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(OC1=CC(OC2=CC=C(C(F)(F)F)C=C2Cl)=CC=C1[N+](=O)[O-])C(=O)Cl.CC1=CC=CC=C1.CCCNCC1OCCO1.CCN(CC)CC Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CCCN(CC1OCCO1)C(=O)C(C)OC1=CC(OC2=CC=C(C(F)(F)F)C=C2Cl)=CC=C1[N+](=O)[O-] ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)C[Al+]CC(C)C.COC(=O)[C@H]1CC[C@H]2[C@@H]3CN(C(C)(C)C)C4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12CC(=O)O.ClCCl.[H-] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CC(C)(C)N1C[C@H]2[C@@H]3CC[C@H](CO)[C@@]3(CC(=O)O)CC[C@@H]2[C@@]2(C)CC[C@H](O)C=C12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC1=CC=C(S(=O)(=O)OCC2CC3=CC(Cl)=CC(C4=CC=CC(Cl)=C4)=C3O2)C=C1.[N-]=[N+]=[N-].[Na+] ",
"input": "",
"output": " [N-]=[N+]=NCC1CC2=CC(Cl)=CC(C3=CC=CC(Cl)=C3)=C2O1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses Br.CC1=CC=C(CO)N=C1C1=CC=CC=N1.CCOCC.O.O=C([O-])[O-].[K+] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CC1=CC=C(CBr)N=C1C1=CC=CC=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CC#N.CCN(C(C)C)C(C)C.COC1=CC=CC=C1N1CCNCC1.ClC1=CC=CC(C2CCN(CCCOC3=CC=C4C=NNC4=C3)CC2)=C1Cl.[I-].[Na+] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " COC1=CC=CC=C1N1CCN(CCCOC2=CC=C3C=NNC3=C2)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CCOC1=CC([C@@H](CCNO)N2CC3=CC=CC(NC(=O)C(C)C)=C3C2=O)=CC=C1OC.N#C[O-].O.[K+] ",
"input": "",
"output": " CCOC1=CC([C@@H](CCN(O)C(N)=O)N2CC3=CC=CC(NC(=O)C(C)C)=C3C2=O)=CC=C1OC ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C1CCOC1.CC(=O)O.CC(C)NC(C)C.CC1CN(C(=O)NC2=CC=C(OC(F)(F)F)C=C2)N=C1C1=CC=C(Cl)C=C1.CCCCCC.COC=O.[Li]CCCC is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC1(C=O)CN(C(=O)NC2=CC=C(OC(F)(F)F)C=C2)N=C1C1=CC=C(Cl)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC1=CC=C(C(O)CN2C3=C(CN(C)CC3)C3=CC(C)=CC=C32)C=C1.O=S(=O)(O)O.[K+].[OH-] .",
"input": "",
"output": " CC1=CC=C(C=CN2C3=C(CN(C)CC3)C3=CC(C)=CC=C32)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CNC(=O)C(=NOC)C1=CC=CC=C1COC1=CC=C(OC(C)C(C)=O)C=C1C.CO.CON Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CNC(=O)C(=NOC)C1=CC=CC=C1COC1=CC=C(OC(C)C(C)=NOC)C=C1C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)C1NC(=O)C=C1O.O=CC1=CC=CC=C1.OCCC1=CNC2=CC(F)=CC=C12 Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CC(C)C1NC(=O)C(C(C2=CC=CC=C2)C2=C(CCO)C3=CC=C(F)C=C3N2)=C1O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1CCOC1.CCOC(=O)CC1OB(O)C2=CC(OC3=NC=CN=C3C#N)=CC(C)=C21.Cl.O.[Na+].[OH-] as the reactants and reagents.",
"input": "",
"output": " CC1=CC(OC2=NC=CN=C2C(=O)O)=CC2=C1C(CC(=O)O)OB2O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC1=CC=C(S(=O)(=O)O)C=C1.CCCCCCCCCCCCO.O=C[C@H](O)[C@H]1OC(=O)[C@@H](O)[C@H]1O as the reactants and reagents.",
"input": "",
"output": " CCCCCCCCCCCCO[C@@H]1O[C@H]2[C@H](OC(=O)[C@H]2O)[C@H]1O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1CCOC1.CC(=O)/C=C(/C)[O-].CN1CCCC1=O.COC(=O)C1=CC=C(Cl)N=C1.FC(F)(F)CC[Mg]Br.O.[Fe+3] ",
"input": "",
"output": " COC(=O)C1=CC=C(CCC(F)(F)F)N=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.CC1=CC=CC=C1.CCCCOC1=C(CO)N(CC(C)(C)C)C(=O)C2=CC(F)=CC=C12.O=C([O-])O.O=S(Cl)Cl.[Na+] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CCCCOC1=C(CCl)N(CC(C)(C)C)C(=O)C2=CC(F)=CC=C12 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CCOC(=O)C=CC1=CC=C(OC2=CC(F)=CC(OC)=C2)C=C1C.CCOC(C)=O.[Pd] ",
"input": "",
"output": " CCOC(=O)CCC1=CC=C(OC2=CC(F)=CC(OC)=C2)C=C1C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1CCOC1.CCO.COC(=O)/C=C/C1=CC=C(S(=O)(=O)C2=CC=CC=C2)C=C1Br.N#N.O=[Pt]=O ",
"input": "",
"output": " COC(=O)CCC1=CC=C(S(=O)(=O)C2=CC=CC=C2)C=C1Br ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC#N.CCN(CC)CC.ClC1=CC=C(CC2CCNCC2)C=C1.[N-]=[N+]=N[C@@H]1CCCC[C@H]1OS(=O)(=O)C1=CC=C([N+](=O)[O-])C=C1 , what product could potentially be produced?",
"input": "",
"output": "The product can be [N-]=[N+]=N[C@H]1CCCC[C@H]1N1CCC(CC2=CC=C(Cl)C=C2)CC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1=CC=CC=C1.CC(C)C1CC(=O)CC(=O)C1.CC1=CC=C(S(=O)(=O)N=C=O)C=C1 as the reactants and reagents.",
"input": "",
"output": " CC1=CC=C(S(=O)(=O)NC(=O)C2C(=O)CC(C(C)C)CC2=O)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCOC(=O)CC#N.COC1=C(O)C(C=O)=CC2=C1OC=C2.Cl.O.[Na+].[OH-] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " COC1=C2OC=CC2=CC2=C1OC(=O)C(C(=O)O)=C2 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C1=CC=C(P(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.CC1=CC=CC=C1.CCCC[Sn](CCCC)(CCCC)C1=C[C@@]2(CC[C@H]3[C@H](S(=O)(=O)C4=CC=CC=C4)C[C@]2(C2=CC=CC=C2)N3CC2=CC=CC=C2)OC1.CCOC(C)=O.COC1=CC=C(OC(F)(F)F)C=C1I.[Cl-].[Cu]I.[Li+].[Pd] , what product could potentially be produced?",
"input": "",
"output": "The product can be COC1=CC=C(OC(F)(F)F)C=C1C1=C[C@@]2(CC[C@H]3[C@H](S(=O)(=O)C4=CC=CC=C4)C[C@]2(C2=CC=CC=C2)N3CC2=CC=CC=C2)OC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CCO.CCOC(=O)C(O)C1CCOC1OC(C)C.Cl.O.OCCNCCO.[BH4-].[Na+] as the reactants and reagents.",
"input": "",
"output": " CC(C)OC1OCCC1C(O)CO ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1=CC=NC=C1.C=C(C)OC(=O)Cl.CC1=CC=C2NC(C)(C)C(=O)NC2=C1.O ",
"input": "",
"output": " C=C(C)OC(=O)N1C2=CC=C(C)C=C2NC(=O)C1(C)C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCN(C(C)C)C(C)C.CN(C)C1=CC=C(C(=O)Cl)C=C1.C[C@H]1C[C@@H](NC(=O)OCC2=CC=CC=C2)C2=CC=CC=C2N1.ClCCl.O Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be C[C@H]1C[C@@H](NC(=O)OCC2=CC=CC=C2)C2=CC=CC=C2N1C(=O)C1=CC=C(N(C)C)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C1CCOC1.CCOC(=O)C1=C(C2=CC=C(Cl)C=C2)C=CN1CC1=CC=CC=C1.CO.[Na+].[OH-] .",
"input": "",
"output": " O=C(O)C1=C(C2=CC=C(Cl)C=C2)C=CN1CC1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CCOC(=O)C[C@H](CC1=CC=C2NN=CC2=C1COC(C)=O)C(=O)OCC.CO.O=C([O-])[O-].[K+] ",
"input": "",
"output": " COC(=O)C[C@H](CC1=CC=C2NN=CC2=C1CO)C(=O)OC ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CCOC(=O)C[C@@H](CC1=CC=C2NN=CC2=C1COC(C)=O)C(=O)OCC.CO.O=C([O-])[O-].[K+] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: COC(=O)C[C@@H](CC1=CC=C2NN=CC2=C1CO)C(=O)OC .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C#CCC(O)(CC)CC.CCN(CC)CC.CN(C)C1=CC=NC=C1.C[Si](C)(C)Cl.ClCCl Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be C#CCC(CC)(CC)O[Si](C)(C)C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CCOCC.Cl.NC1=CC(F)=CC(C(F)(F)F)=C1 as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " O=C=NC1=CC(F)=CC(C(F)(F)F)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. BrC1=CC=CC=C1I.C1CCOC1.CC(C)[Mg]Cl.COC(C)(C)C.COC1=C(C)C=C(P(Cl)C2=CC(C)=C(OC)C(C)=C2)C=C1C ",
"input": "",
"output": " COC1=C(C)C=C(P(C2=CC(C)=C(OC)C(C)=C2)C2=CC=CC=C2Br)C=C1C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CN(C)C=O.O=C(C1=CC=CC(C(F)(F)F)=C1Cl)N1CCN2C=CN=C2C1.O=C1CCC(=O)N1Br ",
"input": "",
"output": " O=C(C1=CC=CC(C(F)(F)F)=C1Cl)N1CCN2C(Br)=CN=C2C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CCOCC.CN(C)C(C1=CC=CC=C1)C1CCCCC1=O.FC(F)(F)C1=CC=C(Br)C=C1.[Cl-].[MgH2].[NH4+] , what product could potentially be produced?",
"input": "",
"output": "The product can be CN(C)C(C1=CC=CC=C1)C1CCCCC1(O)C1=CC=C(C(F)(F)F)C=C1.Cl .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC(C)(C)OC(N)=O.FC1=CC=CC(C2=NN3C=CC(Br)=CC3=N2)=N1 ",
"input": "",
"output": " CC(C)(C)OC(=O)NC1=CC2=NC(C3=CC=CC(F)=N3)=NN2C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1CCOC1.COC(=O)C1=CC=C(CO)N=C1.O.O=S(=O)(OCC(F)(F)F)C(F)(F)F.[H-].[Li+].[Na+].[OH-] ",
"input": "",
"output": " O=C(O)C1=CC=C(COCC(F)(F)F)N=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CCO.CN[C@@H]1CCCC[C@H]1NC.COC1=CC=C2OC3=CC=C(Br)C=C3[C@@]3(COC(N)=N3)C2=C1.O.O=C1O[C@H]([C@@H](O)CO)C(O)=C1O.[Cu]I.[N-]=[N+]=[N-].[Na+].[NaH] ",
"input": "",
"output": " COC1=CC=C2OC3=CC=C(N=[N+]=[N-])C=C3[C@@]3(COC(N)=N3)C2=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CC(C)(O)C(C)(C)O.OB(O)C1=CC=CC(Cl)=C1 as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CC1(C)OB(C2=CC=CC(Cl)=C2)OC1(C)C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CC1=CC=CC=C1.O=C(Cl)CCCCl as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CC1=CC=C(C(=O)CCCCl)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. O.O=C(CNC(=O)C1CN(CC2=CC=CC=C2)CCO1)C1=CC=CC=C1Cl.O=C([O-])C(F)(F)F.[NH4+] ",
"input": "",
"output": " ClC1=CC=CC=C1C1=CNC(C2CN(CC3=CC=CC=C3)CCO2)=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. C1CCOC1.CC=C(C)[Mg]Br.CCCCOC(OCCCC)C1=NC=CC=C1[N+](=O)[O-].CCOC(C)=O.[Cl-].[NH4+] ",
"input": "",
"output": " CCCCOC(OCCCC)C1=NC=CC2=C1NC(C)=C2C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CC(C)C(=O)Cl.CCCN(CC1CCN(S(C)(=O)=O)CC1)C1CCC2=CC=C(N)C=C2C1.CCN(C(C)C)C(C)C.ClCCl as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CCCN(CC1CCN(S(C)(=O)=O)CC1)C1CCC2=CC=C(NC(=O)C(C)C)C=C2C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " BrC1=CN=C(N2CCOCC2)C2=NC(CCC3=CC=C4C=CC=CC4=N3)=CN12.CC1(C)OB(C2=CC=C(C#N)N=C2)OC1(C)C Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be N#CC1=CC=C(C2=CN=C(N3CCOCC3)C3=NC(CCC4=CC=C5C=CC=CC5=N4)=CN23)C=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.CC(C)(C)OC(=O)C(CCN)C(=O)O.CI.[H-].[Na+] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CNCCC(C(=O)O)C(=O)OC(C)(C)C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CCCN1C(=O)C(N)=C(N)N(CCC2=CC=C([N+](=O)[O-])C=C2)C1=O.O=C(O)CC1=NN=NN1 , what product could potentially be produced?",
"input": "",
"output": "The product can be CCCN1C(=O)C2=C(N=C(CC3=NN=NN3)N2)N(CCC2=CC=C([N+](=O)[O-])C=C2)C1=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)O.N#CC1=C(N)C=C(C(=O)NCC2CCN(CC3=CN=C(C4=C(F)C=CC=C4F)S3)CC2)N=C1Cl Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CC(C)OC1=NC(C(=O)NCC2CCN(CC3=CN=C(C4=C(F)C=CC=C4F)S3)CC2)=CC(N)=C1C#N .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C1=CC=C(P(C2=CC=CC=C2)[C-]2C=CC=C2)C=C1.CC(=O)[O-].CC1=CC=CC=C1.COC(=O)C1=CC=C(Br)C=C1C.Cl[Pd]Cl.O.O=C([O-])[O-].OB(O)C1CC1.[Fe+2].[K+].[Pd+2] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: COC(=O)C1=CC=C(C2CC2)C=C1C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CCOC(=O)CC1=CC=CN1C.ClCCl.O=C(Cl)C1=CC=C([N+](=O)[O-])C=C1.[Al+3].[Cl-] ",
"input": "",
"output": " CCOC(=O)CC1=CC=C(CC2=CC=C([N+](=O)[O-])C=C2)N1C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CCO.O=C([O-])[O-].OC1CCNCC1.OCCBr.[Na+] ",
"input": "",
"output": " OCCN1CCC(O)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C#CC1=CC=C2C=NC=C(CC(=O)O)C2=C1.CC(C)CN1C(N)=C(N)C(=O)N(C)C1=O.CCN(C(C)C)C(C)C.CN(C)C=O .",
"input": "",
"output": " C#CC1=CC=C2C=NC=C(CC3=NC4=C(C(=O)NC(=O)N4CC(C)C)N3C)C2=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CO.COC(=O)CN=[N+]=[N-].COC1=CC(C=O)=CC(OC)=C1OC.[NaH] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be COC(=O)C(=CC1=CC(OC)=C(OC)C(OC)=C1)N=[N+]=[N-] .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CC=C(P(C2=CC=CC=C2)[C-]2C=CC=C2)C=C1.CC(C)(C)[O-].CC1=CC=CC(Br)=N1.CC1=CC=CC(N)=N1.CC1=CC=CC=C1.[Fe+2].[Na+] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CC1=CC=CC(NC2=CC=CC(C)=N2)=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC1=CNC(=O)N1C1=CC=CC(C(F)(F)F)=C1.CC[O+](CC)CC.ClCCl.F[B-](F)(F)F.O.[Na+].[OH-] , what product could potentially be produced?",
"input": "",
"output": "The product can be CCOC1=NC=C(C)N1C1=CC=CC(C(F)(F)F)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC(C)(O)C1(CSC2=CC=CC=C2)CC1.ClCCl.O.O=C(OO)C1=CC=CC(Cl)=C1.O=C([O-])O.O=S([O-])([O-])=S.[I-].[K+].[Na+] ",
"input": "",
"output": " CC(C)(O)C1(CS(=O)(=O)C2=CC=CC=C2)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC#N.CCOC(=O)N1C(=O)C2=CC=CC=C2C1=O.COC1=CC=C(C(N)CS(C)(=O)=O)C=C1OC1CCCC1.O.O=C([O-])O.[Na+] ",
"input": "",
"output": " COC1=CC=C(C(CS(C)(=O)=O)N2C(=O)C3=CC=CC=C3C2=O)C=C1OC1CCCC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC(=O)[O-].CCOCC1=NC2=CN=C3C=CC=CC3=C2N1CCC(=O)OCC.O.[NH4+] .",
"input": "",
"output": " CCOCC1=NC2=CN=C3C=CC=CC3=C2N1CCC(N)=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C1COCCO1.CC1(C)C2=CC=CC(P(C3=CC=CC=C3)C3=CC=CC=C3)=C2OC2=C(P(C3=CC=CC=C3)C3=CC=CC=C3)C=CC=C21.COCC1=NC(Cl)=C2C=CC(C3=NC=CC=C3C(F)(F)F)=NC2=N1.Cl.NC1=CC=C(C(F)(F)F)C=N1.O=C(/C=C/C1=CC=CC=C1)/C=C/C1=CC=CC=C1.O=C([O-])[O-].[Cs+].[Pd] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: COCC1=NC(NC2=CC=C(C(F)(F)F)C=N2)=C2C=CC(C3=NC=CC=C3C(F)(F)F)=NC2=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1CCOC1.CC(C)(C)OC(=O)N1CCC(C(=O)CC(=O)C2=CC=CC=C2)CC1.CCO.NN.O as the reactants and reagents.",
"input": "",
"output": " CC(C)(C)OC(=O)N1CCC(C2=CC(C3=CC=CC=C3)=NN2)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC(C)[C@@H](CN1C(=O)C2=CC=CC=C2C1=O)NC1=NC2=C(Br)C=NN2C=C1.CNN.CO , what product could potentially be produced?",
"input": "",
"output": "The product can be CC(C)[C@@H](CN)NC1=NC2=C(Br)C=NN2C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: Br[Mg]C1CCC1.C1CCOC1.CN1N=NC(N(CC2=CC(C(F)(F)F)=CC(C(F)(F)F)=C2)CC2=CC(C(F)(F)F)=CC=C2C=O)=N1.Cl .",
"input": "",
"output": " CN1N=NC(N(CC2=CC(C(F)(F)F)=CC(C(F)(F)F)=C2)CC2=CC(C(F)(F)F)=CC=C2C(O)C2CCC2)=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C=CC1=CC=C(C=C)C=C1.C=CC1=CC=CC=C1.CC(C)N=C=NC(C)C.CC1=CC=C(C(N)C2=CC=CC=C2)C=C1.CCCC[C@H](NC(=O)OCC1C2=CC=CC=C2C2=CC=CC=C21)C(=O)O.CN(C)C1=CC=NC=C1.CN(C)C=O.Cl.ClCCl.O=C(O)CNC(=O)OCC1C2=CC=CC=C2C2=CC=CC=C21.ON1N=NC2=CC=CC=C21 , what product could potentially be produced?",
"input": "",
"output": "The product can be C=CCC(=O)CNC(=O)OCC1C2=CC=CC=C2C2=CC=CC=C21 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC(C)(C)OC(=O)N1CCCC2=C(C1)SC1=NC=NC(Cl)=C21.NC1=CC=C2C(=C1)C=NN2CC1=CC=CC(F)=C1 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: FC1=CC=CC(CN2N=CC3=CC(NC4=NC=NC5=C4C4=C(CNCCC4)S5)=CC=C32)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC1=CC=C([N+](=O)[O-])C=C1N1CC2=CN=C(S(C)(=O)=O)N=C2NC1=O.CCOC(C)=O.CI.CN(C)C=O.[H-].[Na+] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC1=CC=C([N+](=O)[O-])C=C1N1CC2=CN=C(S(C)(=O)=O)N=C2N(C)C1=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if Cl.NCC1=CC=CC=C1.O=C(O)CC(=O)CC(=O)O.O=CCCCC=O is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " O=C1CC2CCCC(C1)N2CC1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CCOC(=O)CO[C@@H](C1=CC(Cl)=CC=C1C)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1.CO.[BH4-].[Na+] , what product could potentially be produced?",
"input": "",
"output": "The product can be CC1=CC=C(Cl)C=C1[C@H](OCCO)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: COCCNCC1=CC(Br)=CN=C1N.ClCCCl.O=C(N1C=CN=C1)N1C=CN=C1 .",
"input": "",
"output": " COCCN1CC2=CC(Br)=CN=C2NC1=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC1=C(C(C)C)C=CC=[N+]1[O-].ClCCl.O=C(OC(=O)C(F)(F)F)C(F)(F)F Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CC(C)C1=CC=CN=C1CO .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC1=C(C(=O)OC(C)C)C(C2=CC=CC(Cl)=C2Cl)C2=C(CC(C)(C)CC2=O)N1.ClCCl.O=[Mn]=O Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CC1=NC2=C(C(=O)CC(C)(C)C2)C(C2=CC=CC(Cl)=C2Cl)=C1C(=O)OC(C)C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC(=O)[O-].CN(C)C=O.CS(C)=O.C[N+](=O)[O-].O=CC1=CNC2=CC=C(C3=CC=C4NC=NC4=C3)C=C12.[NH4+] , what product could potentially be produced?",
"input": "",
"output": "The product can be O=[N+]([O-])C=CC1=CNC2=CC=C(C3=CC=C4NC=NC4=C3)C=C12 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses BrCCC1OCCCO1.C1CCOC1.COC1=CC(C(C)(C)C)=C(OC(C)=O)C(C(C)(C)C)=C1CC(C)=O.[Cl-].[MgH2].[NH4+] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: COC1=CC(C(C)(C)C)=C(OC(C)=O)C(C(C)(C)C)=C1CC(C)(O)CCC1OCCO1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC1=CC=CC=C1N.COC1=CC=CC(C2=NC(N3CCOCC3)=NC(Cl)=C2CCCl)=C1.COC1=CC=CC(C2=NC(N3CCOCC3)=NC3=C2CCN3C2=CC=CC=C2C)=C1 ",
"input": "",
"output": " CC1=CC=CC=C1N1CCC2=C(C3=CC=CC(O)=C3)N=C(N3CCOCC3)N=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC(=O)O.CCCOC1=CC=C2C=C(C(=O)OCC)C(C(F)(F)F)OC2=C1.ClCl.[Zn] ",
"input": "",
"output": " CCCOC1=CC2=C(C=C(C(=O)OCC)C(C(F)(F)F)O2)C=C1Cl ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C1CCOC1.CC(=NO)C(C)=NO.CC(=O)O.CN(C)C=O.O.O=C1NC(=O)C(=CC2=CC=C(OCC3CCCCC3)C(Cl)=C2)S1.[BH4-].[Na+].[OH-] , what product could potentially be produced?",
"input": "",
"output": "The product can be O=C1NC(=O)C(CC2=CC=C(OCC3CCCCC3)C(Cl)=C2)S1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if BrBr.CO.O=C(NC1=CC=CC=C1)C(F)(F)F.O=C([O-])O.[Na+] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " O=C(NC1=CC=CC=C1Br)C(F)(F)F ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CC(C)C1=CC=C(N(CC2=CC=C(N(C)C)C=C2)C(=O)C2CCCC3=CC(O)=CC=C32)C=C1.OCCBr as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CC(C)C1=CC=C(N(CC2=CC=C(N(C)C)C=C2)C(=O)C2CCCC3=CC(OCCO)=CC=C32)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CCN(CC)CC.COC1=CC=C2OCC(=O)N(CCO)C2=C1.CS(C)=O.ClCCl.O=C(Cl)C(=O)Cl ",
"input": "",
"output": " COC1=CC=C2OCC(=O)N(CC=O)C2=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC1=CC=C([C@H](N)CN(C)S(=O)(=O)C2=CC=C([N+](=O)[O-])C=C2)C=C1C(F)(F)F.NC(=O)C1=CC=NC2=C(O)N=CN=C12 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CNC[C@@H](NC1=NC=NC2=C(C(N)=O)C=CN=C12)C1=CC=C(C)C(C(F)(F)F)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with BrCCC1=CC=CC=C1.C1CCOC1.CCOCC.CN1C2=CC=NC=C2N=CC2=CC=CN21.[Cl-].[MgH2].[NH4+] as the reactants and reagents.",
"input": "",
"output": " CN1C2=CC=NC=C2NC(CCC2=CC=CC=C2)C2=CC=CN21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C=C1[C@H](COCC2=CC=CC=C2)[C@@H](OCC2=CC=CC=C2)[C@H](OCC2=CC=CC=C2)[C@@H](OCC2=CC=CC=C2)[C@@H]1C1=CC=C(Cl)C(CC2=CC=C(CC)C=C2)=C1.CO.ClB(Cl)Cl.ClCCl ",
"input": "",
"output": " C=C1[C@H](CO)[C@@H](O)[C@H](O)[C@@H](O)[C@@H]1C1=CC=C(Cl)C(CC2=CC=C(CC)C=C2)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. NC1=CC=CC(C(=O)O)=C1.O=S(=O)(Cl)C1=CC=C(C2=NOC=C2)S1 ",
"input": "",
"output": " O=C(O)C1=CC=CC(NS(=O)(=O)C2=CC=C(C3=NOC=C3)S2)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)(C)OC(=O)N[C@H](CC1=CC=C2C=CC=CC2=C1)C(=O)O.CC(C)O.CN1CCOCC1.O Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CC(C)(C)OC(=O)N[C@H](CC1=CC=C2C=CC=CC2=C1)C(=O)ON1C(=O)CCC1=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC(=O)N(C)C.CC1=CC=C(S(=O)(=O)N2C=CC3=C2N=CC2=NN=C(C45CCC(N)(CC4)CC5)N23)C=C1.CCN(C(C)C)C(C)C.O=C([O-])[O-].O=S(=O)(Cl)N1CCCC1.[K+] ",
"input": "",
"output": " CC1=CC=C(S(=O)(=O)N2C=CC3=C2N=CC2=NN=C(C45CCC(NS(=O)(=O)N6CCCC6)(CC4)CC5)N23)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CCCC[N+](CCCC)(CCCC)CCCC.ClCCCCBr.FC1=CC=C2N=NNC2=C1.[Br-].[Na+].[OH-] .",
"input": "",
"output": " FC1=CC=C2N=NN(CCCCCl)C2=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1CCOC1.CC(C)(C)OC(=O)C1=CC=C(C2=CC=CC=C2)C=C1N.CCN(CC)CC.CCOC(C)=O.CN(C)C=O.Cl.ClCCl.N#CC1=CC=CC(C(=O)O)=C1.O=C(Cl)C(=O)Cl ",
"input": "",
"output": " CC(C)(C)OC(=O)C1=CC=C(C2=CC=CC=C2)C=C1NC(=O)C1=CC=CC(C#N)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C1CCOC1.NNC(=O)CC1CCC(C2=NC3=C(C4=CC=C(C5=CC=CC=C5)N=C4)C=NN3C(N)=C2)CC1.O=C(N1C=CN=C1)N1C=CN=C1 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " NC1=CC(C2CCC(CC3=NNC(=O)O3)CC2)=NC2=C(C3=CC=C(C4=CC=CC=C4)N=C3)C=NN12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C=C(C)C(=O)OCCN(C)C.CC(C)OC(C)C.CCCCCCCCCCCCBr.COC1=CC=C(O)C=C1 as the reactants and reagents.",
"input": "",
"output": " C=C(C)C(=O)OCC[N+](C)(C)CCCCCCCCCCCC.[Br-] ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(=O)CC(=O)C1=CC=CO1.CO.NN Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CC1=CC(C2=CC=CO2)=NN1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC(=O)OCC1=C(B2OC(C)(C)C(C)(C)O2)C=CC=C1N1N=CC2=CC(C(C)(C)C)=CC(F)=C2C1=O.CC(C)C1=CC(C(C)C)=C(C2=CC=CC=C2P(C2CCCCC2)C2CCCCC2)C(C(C)C)=C1.CCCCO.CN1N=C(Cl)C=C(NC2=CN=C([C@H]3COC(C)(C)O3)C=N2)C1=O.O.O=P([O-])([O-])[O-].[Cl-].[K+].[NH4+] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CN1N=C(C2=CC=CC(N3N=CC4=CC(C(C)(C)C)=CC(F)=C4C3=O)=C2CO)C=C(NC2=CN=C([C@H]3COC(C)(C)O3)C=N2)C1=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. C1CCC2=NCCCN2CC1.C1CCOC1.CC(C)S(N)(=O)=O.COC1=CC=C2C(=C1)C=C(C(=O)N1C3CCC1CN(C)C3)CN1C2=C(C2CCCCC2)C2=CC=C(C(=O)OC(C)(C)C)C=C21.O=C(N1C=CN=C1)N1C=CN=C1.O=C(O)C(F)(F)F ",
"input": "",
"output": " COC1=CC=C2C(=C1)C=C(C(=O)N1C3CCC1CN(C)C3)CN1C2=C(C2CCCCC2)C2=CC=C(C(=O)NS(=O)(=O)C(C)C)C=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1CCOC1.CC(=O)O.CC(=O)[O-].CC(C)(C)OC(=O)NCCCNC(N)=S.O=CC(Br)C=O.[Na+] ",
"input": "",
"output": " CC(C)(C)OC(=O)NCCCNC1=NC=C(C=O)S1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C1CCOC1.CC(C)OB1OC(C)(C)C(C)(C)O1.CCCCCC(C)(C)C1=CC(OC)=C(B2OC(C)(C)C(C)(C)O2)C(OC)=C1.[Li]CCCC as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CCCCCC1=CC(OC)=C(B2OC(C)(C)C(C)(C)O2)C(OC)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC(=O)OCC(C)C.COC1=CC(C(C)=O)=CC=C1OCCCCl.O=C(C1=CC=C(F)C=C1)C1(O)CCNCC1.O=C([O-])[O-].[Na+] ",
"input": "",
"output": " COC1=CC(C(C)=O)=CC=C1OCCCN1CCC(O)(C(=O)C2=CC=C(F)C=C2)CC1.Cl ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCC2=NCCCN2CC1.CN(C)C=O.CN(C)CCC(=O)O.Cl.ClCCl.O.O=C1C2=CC=CC=C2C(Cl)N1C1=CC=C2C=CC(Cl)=NC2=N1 Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CN(C)CCC(=O)OC1C2=CC=CC=C2C(=O)N1C1=CC=C2C=CC(Cl)=NC2=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CNC(=S)NC1CC1.NS(=O)(=O)C1=CC(C(=O)CBr)=CC=C1Cl as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: Br.CN1C(=NC2CC2)SCC1(O)C1=CC=C(Cl)C(S(N)(=O)=O)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with ClC(Cl)Cl.O=S(Cl)Cl.OCC1=CN(C(C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=N1 as the reactants and reagents.",
"input": "",
"output": " ClCC1=CN(C(C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CC=C(P(C2=CC=CC=C2)[C-]2C=CC=C2)C=C1.COCCOC.Cl[Pd]Cl.O=C(NC1=CC=C(OC(F)(F)Cl)C=C1)C1=CN=C(Cl)C(I)=C1.O=C([O-])[O-].OB(O)C1=CN=CN=C1.[Fe+2].[Na+] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be O=C(NC1=CC=C(OC(F)(F)Cl)C=C1)C1=CN=C(Cl)C(C2=CN=CN=C2)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. BrCC1=CC=CC=C1.C1=CN2CCCNC2CCC1.CC1=CC=CC=C1 ",
"input": "",
"output": " C1=CC=C(CN2CCCN3CCCCCC32)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CCOC(C)=O.CN(C)C=O.CN(CC1=CC=CC=C1)C(=O)C1CCN(C(=O)C2=CC3=CC=CC=C3N2)CC1.N#CC1=CC=C(CI)C=C1.O.[H-].[Na+] , what product could potentially be produced?",
"input": "",
"output": "The product can be CN(CC1=CC=CC=C1)C(=O)C1CCN(C(=O)C2=CC3=CC=CC=C3N2CC2=CC=C(C#N)C=C2)CC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CCN(CC)CC.CCOC(OCC)C1=CC=CC(CCO)=C1.CS(=O)(=O)Cl.ClCCl is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CCOC(OCC)C1=CC=CC(CCOS(C)(=O)=O)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " BrCC1=CC=CC=C1.CCOC(C)=O.CN(C)C=O.COC1=CC=C(CN2CCC3=NNC4=NC(SC)=NC2=C34)C=C1.O.O=C([O-])[O-].[Cs+].[I-].[Na+] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be COC1=CC=C(CN2CCC3=NN(CC4=CC=CC=C4)C4=NC(SC)=NC2=C34)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C1CCNC1.C=C1CC(=O)O1.CC(C)=O.CC1=CC=CC=C1 .",
"input": "",
"output": " CC(=O)CC(=O)N1CCCC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CC(=O)O.CN(C)C=O.CO.ClCCl.O=C(O)C(F)(F)F.O=C([O-])O.O=C1CCC(C2=CC=C(OC3CCNCC3)C=C2F)=NN1.O=C1CCC1.[BH3-]C#N.[Na+] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " O=C1CCC(C2=CC=C(OC3CCN(C4CCC4)CC3)C=C2F)=NN1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC(=O)O[BH-](OC(C)=O)OC(C)=O.CC(C)(C)OC(=O)CC[C@H](N)C1CCCCC1.CCOC(C)=O.ClCCl.O=CC1=CC(OC2=CC=CC=C2)=NC=C1[N+](=O)[O-].[Na+] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CC(C)(C)OC(=O)CC[C@H](NCC1=CC(OC2=CC=CC=C2)=NC=C1[N+](=O)[O-])C1CCCCC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C1COCCO1.CC(C)(C)OC(=O)N1CCN(C2=NC3=C(C4=CN=C5C=CC=CC5=C4)C=NN3C(N)=C2Br)CC1.Cl .",
"input": "",
"output": " NC1=C(Cl)C(N2CCNCC2)=NC2=C(C3=CN=C4C=CC=CC4=C3)C=NN12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC(C)(C)OC(=O)NCC(=O)NCC(=O)OCC1=CC=CC=C1.CCOC(C)=O.Cl as the reactants and reagents.",
"input": "",
"output": " NCC(=O)NCC(=O)OCC1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC(=O)O.COC1=CC=C2C=CC=C(N3CC[C@H](NC(=O)OC(C)(C)C)C3=O)C2=N1 .",
"input": "",
"output": " CC(C)(C)OC(=O)N[C@H]1CCN(C2=CC=CC3=CC=C(O)N=C23)C1=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: BrCC1=CC=C(Br)C=C1.CN(C)C=O.COC1=CC=C(NN)C=C1.Cl.O=C([O-])[O-].[K+] , what product could potentially be produced?",
"input": "",
"output": "The product can be COC1=CC=C(N(N)CC2=CC=C(Br)C=C2)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C#CC(C)O.O=C(Cl)C1=CC=CC2=CC=CC=C12.[Na+].[OH-] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be C#CC(C)OC(=O)C1=CC=CC2=CC=CC=C12 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C1COCCO1.CC(C)(C#N)C(NS(=O)C(C)(C)C)C1CC1.CO.Cl is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC(C)(C#N)C(N)C1CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C1COCCO1.CC(=O)OCC1=C(C2=CN(C)C(=O)C(N(C(=O)OC(C)(C)C)C3=CC=C(CN4CCN(C)CC4)C=N3)=C2)C=CC=C1N1N=CC2=CC(C(C)(C)C)=CC(F)=C2C1=O.CCOC(C)=O.O.[Li+].[OH-] .",
"input": "",
"output": " CN1CCN(CC2=CC=C(NC3=CC(C4=CC=CC(N5N=CC6=CC(C(C)(C)C)=CC(F)=C6C5=O)=C4CO)=CN(C)C3=O)N=C2)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CC(C)(C)C1=CC=CC(NC(=O)C2=CC=C(Cl)N=C2)=C1.CCOC(=O)C1=CC=C(N2CCN(C3=CC=C(C(=O)NC4=CC=C(C)C(I)=C4)C=N3)CC2)C=C1.CCOC(=O)C1=CC=C(N2CCNCC2)C=C1.CCOC(C)=O as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CCOC(=O)C1=CC=C(N2CCN(C3=CC=C(C(=O)NC4=CC=CC(C(C)(C)C)=C4)C=N3)CC2)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. BrC1=CC=C(Br)C2=CC=CC=C12.C1CCOC1.Cl.II.O.O=C=O.[MgH2] ",
"input": "",
"output": " O=C(O)C1=CC=C(Br)C2=CC=CC=C12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC(Br)C1=CC=CC=C1.COC1=CC(SCC2=CC=CC(Cl)=C2)=CN=C1OC is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " COC1=CC(SC(C)C2=CC=CC=C2)=CN=C1OC ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C=CCON=C1C[C@@H](C(=O)O)N(C(=O)OC(C)(C)C)C1.COCCN.N#CC1=CC=C(C(=O)Cl)C=C1 ",
"input": "",
"output": " C=CCON=C1C[C@@H](C(=O)NCCOC)N(C(=O)C2=CC=C(C#N)C=C2)C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " Br.COC1=CC=C(C2=CC=C3C(C4=CC=CN=C4)=COC3=C2)C=C1OC Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " OC1=CC=C(C2=CC=C3C(C4=CC=CN=C4)=COC3=C2)C=C1O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1COCCO1.CC1(CO[Si](C)(C)C(C)(C)C)CC2=NN=C(C3(C4=CC=C(Cl)C=C4)CC3)N2CCS1.CN(C)C(=O)C1=CC=CC(B(O)O)=C1.CO.Cl.O.O=C(/C=C/C1=CC=CC=C1)/C=C/C1=CC=CC=C1.O=P([O-])([O-])[O-].[K+].[Pd] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CN(C)C(=O)C1=CC=CC(C2=CC=C(C3(C4=NN=C5CC(C)(CO)SCCN54)CC3)C=C2)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if BrCC1=CC=CC=C1.C=C[C@]1(CO)CCC(=O)O1.CN(C)C=O.O=[Ag-] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " C=CC1(COCC2=CC=CC=C2)CCC(=O)O1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1COCCO1.CC1(C)OBOC1(C)C.CC1=CC=C(C(=O)NCCCN2CCOCC2)C=C1I.CCN(CC)CC.Cl[Pd](Cl)([PH](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1)[PH](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1 ",
"input": "",
"output": " CC1=CC=C(C(=O)NCCCN2CCOCC2)C=C1B1OC(C)(C)C(C)(C)O1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC(=O)NC1=CC=C2C(=O)COC2=C1.CCOC(C)=O.CO.Cl.O=C([O-])O.[Na+] .",
"input": "",
"output": " NC1=CC=C2C(=O)COC2=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC(C)(O)C(Cl)(Cl)Cl.CC(C)=O.NC1=CC=C(CCOCOCC2=CC=CC=C2)C=C1.O.[K+].[OH-] ",
"input": "",
"output": " COC(=O)C(C)(C)NC1=CC=C(CCOCOCC2=CC=CC=C2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. C1COCCO1.CC(C)(C)S(=O)N[C@@](C)(C[C@H](O)C(F)(F)F)C1=CC=CC(F)=C1F.CO.Cl.ClCCl ",
"input": "",
"output": " C[C@](N)(C[C@H](O)C(F)(F)F)C1=CC=CC(F)=C1F ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C=CN1C=NC=N1.CC(C)(CC1=CNC2=C(CS(=O)(=O)C(F)(F)F)C=CC=C12)NC(=O)OC(C)(C)C ",
"input": "",
"output": " CC(C)(CC1=CNC2=C(C=CN3C=NC=N3)C=CC=C12)NC(=O)OC(C)(C)C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC1(C)CC(N)CC(C)(C)N1.CSC1=NC(C2=CC(C(=O)O)=CC=C2C)=C2C=CC(=O)N(C3=C(F)C=CC=C3F)C2=N1.NCCC1=CC=C(F)C=C1 ",
"input": "",
"output": " CC1=CC=C(C(=O)NCCC2=CC=C(F)C=C2)C=C1C1=NC(NC2CC(C)(C)NC(C)(C)C2)=NC2=C1C=CC(=O)N2C1=C(F)C=CC=C1F ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if Br.CCOC(=O)NC1=CC(Cl)=CC=C1C#N.O=C(CBr)C1=CC=NC=C1 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CCOC(=O)N1C(C(=O)C2=CC=NC=C2)=C(N)C2=CC=C(Cl)C=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CC(C)C1=CC=CC(CNC[C@@H](O)[C@@H](N)CC2=CC=CC=C2)=C1.CCCN1CCC[C@@]12CCN([C@@H](C)C(=O)O)C2=O.CN(C)C(ON1N=NC2=CC=CC=C21)=[N+](C)C.CN1CCOCC1.Cl.ClCCl.F[B-](F)(F)F as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CCCN1CCC[C@@]12CCN([C@@H](C)C(=O)N[C@@H](CC1=CC=CC=C1)[C@H](O)CNCC1=CC=CC(C(C)C)=C1)C2=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " BrP(Br)Br.CN(C)C=O.N#CC1=CC=C2NC=CC(=O)C2=C1.[Na+].[OH-] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be N#CC1=CC=C2N=CC=C(Br)C2=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1CCOC1.CCOC(=O)C=P(C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1.O=CC1CCCN1C(=O)OCC1=CC=CC=C1 ",
"input": "",
"output": " CCOC(=O)C=C[C@H]1CCCN1C(=O)OCC1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CSC(C2=CC=NO2)=C1.COC(OC)N(C)C Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CN(C)C=C(C#N)C(=O)C1=CC=CS1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC#N.CC1=CC=CC=C1.CC1=NC=CC=C1C#N.CCO.NCCN.O.O=[Mn](=O)(=O)[O-].O=[Si]=O.S.[K+] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CC1=NC=CC=C1C1=NC=CN1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CC1=NC2=CC(OC3=CC(Cl)=NC=N3)=CC(Cl)=C2N1.CCN(C(C)C)C(C)C.CN(C)C=O.Cl.O=C1NC2=NC=CC=C2C2(CCNCC2)O1 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CC1=NC2=CC(OC3=CC(N4CCC5(CC4)OC(=O)NC4=NC=CC=C45)=NC=N3)=CC(Cl)=C2N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC1=NC2=CC=CC=C2C1(C)C.COC1=CC=C(CBr)C=C1.ClC(Cl)Cl.[K+].[OH-] .",
"input": "",
"output": " C=C1N(CC2=CC=C(OC)C=C2)C2=CC=CC=C2C1(C)C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CN(C)C=O.NC(=O)C1=CC=CC(C(N)=O)=C1[N+](=O)[O-].[Pd] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " NC(=O)C1=CC=CC(C(N)=O)=C1N ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C=C1CCCCC1.CC1CCCCC1.CCOC(=O)C=[N+]=[N-].[Cu] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CCOC(=O)C1CC12CCCCC2 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses COC(=O)C1=CC=C(S(=O)(=O)NCC2=CC=C3C=COC3=C2)C=C1.FC(F)(F)C1=CN=C(Cl)C(Cl)=C1 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: COC(=O)C1=CC=C(S(=O)(=O)N(CC2=CC=C3C=COC3=C2)C2=NC=C(C(F)(F)F)C=C2Cl)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CCOC(=O)COC1=CC=C2C=C(S(N)(=O)=O)OC2=C1.[Na+].[OH-] ",
"input": "",
"output": " NS(=O)(=O)C1=CC2=CC=C(OCC(=O)O)C=C2O1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: COC1=CC(C(=O)C2=CSC(C3=CC=CC=C3)=N2)=CC(OC)=C1OC.N#CC1=CC=C(C#N)C=C1.N[C@@H](CS)C(=O)O .",
"input": "",
"output": " COC1=CC(C(=O)C2=CSC(C3=CC=C(CC#N)C=C3)=N2)=CC(OC)=C1OC ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CCO.CCOCC.CN1[C@@H]2C[C@@H](OC(=O)[C@H](CO)C3=CC=CC=C3)C[C@H]1[C@@H]1O[C@H]12.Cl.[BH4-].[Na+] , what product could potentially be produced?",
"input": "",
"output": "The product can be CN1C2CC(O)CC1C1OC12 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC(=O)O.CCCC1=CC(N)=C(C)C=C1C(F)(C(F)(F)F)C(F)(F)F.CCOC(C)=O.CS(C)=O.[BH4-].[Na+] .",
"input": "",
"output": " CCCC1=CC(N)=C(C)C=C1C(C(F)(F)F)C(F)(F)F ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using O=C1NC2=CC(C(F)(F)F)=CN=C2N1.O=P(Cl)(Cl)Cl as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " FC(F)(F)C1=CN=C2N=C(Cl)NC2=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC1=CC=CC=C1.CCOC(=O)N=C=S.NC1=NNC(C2=CC=CC=C2)=C1 Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CCOC(=O)NC(=S)NC1=CC(C2=CC=CC=C2)=NN1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.CC(=O)OC(C)(C)C(=O)NS(=O)(=O)C1=CC(Cl)=CC=C1OCC(=O)N1C[C@H](C)N(CC2=CC=C(F)C=C2)C[C@H]1C.CO.O.[Li+].[OH-] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be C[C@@H]1CN(CC2=CC=C(F)C=C2)[C@@H](C)CN1C(=O)COC1=CC=C(Cl)C=C1S(=O)(=O)NC(=O)C(C)(C)O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC1=CC=C2NC3=C(CN(C)CC3)C2=C1.CC1=CN=CC=N1.CN(C)C=O.O=C(O)[C@@H]1CCCN1.O=P([O-])([O-])[O-].[Cu]I.[K+] , what product could potentially be produced?",
"input": "",
"output": "The product can be C/C(=C\\N1C2=C(CN(C)CC2)C2=CC(C)=CC=C21)C1=CN=C(C)C=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC1=CC=C(N)C(C)=C1.NCC1CCCCC1.O=C(O)C1=CC=CC(CN2C(=O)C3(COC4=CC5=C(C=C43)CCO5)C3=CC=CC=C32)=C1.O=C(O)C1=CC=CC=C1CN1C(=O)C2(COC3=CC4=C(C=C32)CCO4)C2=CC=CC=C21 , what product could potentially be produced?",
"input": "",
"output": "The product can be CC1=CC=C(NC(=O)C2=CC=CC=C2CN2C(=O)C3(COC4=CC5=C(C=C43)CCO5)C3=CC=CC=C32)C(C)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1=CNC=N1.CC(C)(C)OC(=O)N1N=C(C2=CC3=CC(OCCN4CCOCC4)=CC=C3N2C(=O)OC(C)(C)C)C2=CC(O)=CC=C21.CP(=O)(Cl)C1=CC=CC=C1.ClCCl ",
"input": "",
"output": " CC(C)(C)OC(=O)N1N=C(C2=CC3=CC(OCCN4CCOCC4)=CC=C3N2C(=O)OC(C)(C)C)C2=CC(OP(C)(=O)C3=CC=CC=C3)=CC=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(S)S.COC1=CC=CC2=C1SC1=C2C(N2CCN(C)CC2)=NC2=CC=C(F)C=C2N1.ClCCl.[Al+3].[Cl-] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CN1CCN(C2=NC3=CC=C(F)C=C3NC3=C2C2=CC=CC(O)=C2S3)CC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC1=CC=C(CC#N)C(OCC2=CC=CC=C2)=C1.CCO.O.[Na+].[OH-] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CC1=CC=C(CC(=O)O)C(OCC2=CC=CC=C2)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC#N.CC(C)(C)OC(=O)N1CCC(N)CC1.CCN(C(C)C)C(C)C.Cl.N#CC1=CC=C2OC(Cl)=NC2=C1 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CC(C)(C)OC(=O)N1CCC(NC2=NC3=CC(C#N)=CC=C3O2)CC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC(=O)[O-].CC1(C)OB(B2OC(C)(C)C(C)(C)O2)OC1(C)C.CS(C)=O.ClCCl.FC(F)(F)C1=CC=CN=C1N1N=CC2=C(I)C=CN=C21.[K+] ",
"input": "",
"output": " OB(O)C1=CC=NC2=C1C=NN2C1=NC=CC=C1C(F)(F)F ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CCO.CN(C)C=O.CN1C(=O)NC2=CN=C(/C=C/C3=CC=CC=C3)N=C21.[Pd] , what product could potentially be produced?",
"input": "",
"output": "The product can be CN1C(=O)NC2=CN=C(CCC3=CC=CC=C3)N=C21 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC#CCOC1=CC=C(S(=O)(=O)N(C)C(C(=O)O)C2=CC=C(OCCCNC(=O)OCC)C=C2)C=C1.CN(C)C=O.NO.ON1N=NC2=CC=CC=C21 ",
"input": "",
"output": " CC#CCOC1=CC=C(S(=O)(=O)N(C)C(C(=O)NO)C2=CC=C(OCCCNC(=O)OCC)C=C2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. BrB(Br)Br.COC1=CC(F)=C(CC(=O)O)C(F)=C1.ClCCl ",
"input": "",
"output": " COC(=O)CC1=C(F)C=C(O)C=C1F ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1CCC2=NCCCN2CC1.CC#N.CCC(NC(=O)C(N)CC1CCCCC1)C(O)C1=NC2=CC=CC=C2O1.COC(=NS(C)(=O)=O)C1=CC=CC=C1 ",
"input": "",
"output": " CCC(NC(=O)C(CC1CCCCC1)NC(=NS(C)(=O)=O)C1=CC=CC=C1)C(O)C1=NC2=CC=CC=C2O1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC(C)(O)C1=CC=C(CN)C=C1.CCN=C=N.CN(C)C(=O)C1=CC=CC(OC2C(C(=O)O)=CC=CN2CC2=CC=C(C(C)(C)O)C=C2)=C1.CN(C)C=O.Cl.O.ON1N=NC2=CC=CC=C21 ",
"input": "",
"output": " CN(C)C(=O)C1=CC=CC(OC2=NC=CC=C2C(=O)NCC2=CC=C(C(C)(C)O)C=C2)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " BrC1=CC=C(C2CN(CC3=CC=CC=C3)CCO2)C=C1.C1CCOC1.CON(C)C(=O)C1=CC=CC(C(F)(F)F)=C1.[Li]CCCC Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be O=C(C1=CC=C(C2CN(CC3=CC=CC=C3)CCO2)C=C1)C1=CC=CC(C(F)(F)F)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC(=O)O.CCCCCC.CCOCC.N#CC1=C(Cl)NC(C2=CC=C(Cl)C(Cl)=C2)=C1.O=S(=O)(Cl)Cl ",
"input": "",
"output": " N#CC1=C(Cl)NC(C2=CC=C(Cl)C(Cl)=C2)=C1Cl ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. BrC1=CN=CC(OC2=CN=CN=C2)=C1.CC(C)(C)OC(N)=O.CC(C)(C)[O-].CC(C)C1=CC(C(C)C)=C(C2=CC=CC=C2P(C(C)(C)C)C(C)(C)C)C(C(C)C)=C1.CC1=CC=CC=C1.ClC(Cl)Cl.O=C(/C=C/C1=CC=CC=C1)/C=C/C1=CC=CC=C1.[Na+].[Pd] ",
"input": "",
"output": " CC(C)(C)OC(=O)NC1=CN=CC(OC2=CN=CN=C2)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C.CC(C)(C)OC(=O)N1CCC[C@@H](NC2=C(C3=NC4=CC=CC=C4S3)C(=O)NC(C3CCN(C(=O)OCC4=CC=CC=C4)CC3)=N2)C1.CO.[Pd] ",
"input": "",
"output": " CC(C)(C)OC(=O)N1CCC[C@@H](NC2=C(C3=NC4=CC=CC=C4S3)C(=O)NC(C3CCNCC3)=N2)C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CN(C)C=O.N#CC1=NC2=CC=C(COC3=CC=CC(/C=C/C4=CC=C5C=CC(Cl)=CC5=N4)=C3)C=C2O1.[Cl-].[N-]=[N+]=[N-].[NH4+].[Na+].[OH-] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be ClC1=CC=C2C=CC(/C=C/C3=CC=CC(OCC4=CC=C5N=C(C6=NN=NN6)OC5=C4)=C3)=NC2=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CN1C(=O)CCC2=CC(C3=CN=CC(O[C@H]4CCN(C(=O)OC(C)(C)C)C4)=C3)=C(F)C=C21.CO.Cl .",
"input": "",
"output": " CN1C(=O)CCC2=CC(C3=CN=CC(O[C@H]4CCNC4)=C3)=C(F)C=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC1(C2=CC=C(CN3C=CC(N)=N3)O2)OCCO1.O=C(O)C1=C(C2=CC=CC=C2)OC(CC2=CC=CC=C2)=N1 .",
"input": "",
"output": " CC(=O)C1=CC=C(CN2C=CC(NC(=O)C3=C(C4=CC=CC=C4)OC(CC4=CC=CC=C4)=N3)=N2)O1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC(C)(C)C1=CC(O)=NC=N1.O=P(Cl)(Cl)Cl ",
"input": "",
"output": " CC(C)(C)C1=CC(Cl)=NC=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC(=O)O.C[C@@H]([C@@H](CC1CCC(C2=CC=CC=C2)CC1)C(=O)N[C@H](C(=O)NC1=NC=CS1)C(C)(C)C)N(C=O)OC1CCCCO1 .",
"input": "",
"output": " C[C@@H]([C@@H](CC1CCC(C2=CC=CC=C2)CC1)C(=O)N[C@H](C(=O)NC1=NC=CS1)C(C)(C)C)N(O)C=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CO.COC1=CC=C(C(N[C@H](C)C2=CC=CC(F)=C2)C2=CC=CC([N+](=O)[O-])=C2)C=C1.Cl[Ni]Cl.O.[BH4-].[Na+] , what product could potentially be produced?",
"input": "",
"output": "The product can be COC1=CC=C(C(N[C@H](C)C2=CC=CC(F)=C2)C2=CC=CC(N)=C2)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC(C)(C)[O-].NC1=NC(F)=NC2=C1N=CN2C1CCCCO1.OC1CCCCC1.[Na+] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " NC1=NC(OC2CCCCC2)=NC2=C1N=CN2C1CCCCO1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CC(C)(C)C1=CC=C2N=C(Cl)NC2=C1.ClC1=CN=CC(Cl)=C1N1CCNCC1 as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CC(C)(C)C1=CC=C2N=C(N3CCN(C4=C(Cl)C=NC=C4Cl)CC3)NC2=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1CCOC1.CC(C)(SC1=NC(CC(=O)O)=CS1)C(=O)O.CCCCCC1=CC=C(N)C=C1 as the reactants and reagents.",
"input": "",
"output": " CCCCCC1=CC=C(NCCC2=CSC(SC(C)(C)C(=O)O)=N2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses FC1=CC2=NC=C(N3CC4CNCC4C3)N=C2C=C1F.O=C(O)C1=CC=CC(F)=C1N1N=CC=N1 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: O=C(C1=CC=CC(F)=C1N1N=CC=N1)N1CC2CN(C3=CN=C4C=C(F)C(F)=CC4=N3)CC2C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC(=O)OC(C)=O.O.O=C(O)C1=CC=CC(O)=C1 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC(=O)OC1=CC=CC(C(=O)O)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CCC(=O)C(=CN(C)C)C(C)=O.CO.C[O-].N#CCC(N)=O.[Na+] as the reactants and reagents.",
"input": "",
"output": " CCC(=O)C1=C(C)NC(=O)C(C#N)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC1=CC=CC=C1C.CCOC(=O)CC(C)=O.OC(C1=CC=C2NCCCC2=C1)(C(F)(F)F)C(F)(F)F Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CC(=O)CC(=O)N1CCCC2=CC(C(O)(C(F)(F)F)C(F)(F)F)=CC=C21 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C1CCOC1.CO.COC(=O)C(C)(C)CCOC1=CC=C(C(=O)N2C3=CC=CC=C3[C@H](N(C(C)=O)C3=CC=C(Cl)C=C3)C[C@@H]2C)C=C1F.Cl.[Li+].[OH-] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CC(=O)N(C1=CC=C(Cl)C=C1)[C@@H]1C[C@H](C)N(C(=O)C2=CC=C(OCCC(C)(C)C(=O)O)C(F)=C2)C2=CC=CC=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C1=CC=NC=C1.C1CCOC1.Cl.NO.O=CC1=CC=CC2=C1NC1=C2CCC1.O=S(=O)([O-])[O-].[Al+3].[H-].[Li+].[Na+] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: NCC1=CC=CC2=C1NC1=C2CCC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. COC1=CC=C(CCN)C=C1OC.ClC(Cl)Cl.O.OC(O)C(Cl)(Cl)Cl ",
"input": "",
"output": " COC1=CC=C(CCNC=O)C=C1OC ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. Br.CCI.CN(C)C=O.OC1=CC=C(C2=C(C3=CC=NC=C3)N3CCCC3=N2)C=C1.[H-].[Na+] ",
"input": "",
"output": " CCOC1=CC=C(C2=C(C3=CC=NC=C3)N3CCCC3=N2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if COC1=CC=CC(F)=C1CCC#N.NC1=CC2=C(C=C1C=O)OCO2 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " COC1=CC=CC(F)=C1CC1=CC2=CC3=C(C=C2N=C1N)OCO3 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CCOCC.COC1=CC=C(CNC(=O)C2=CN=C3C(=C2NCCNC(=O)OC(C)(C)C)C(C)=NN3C)C=C1.ClCCl.O=S(=O)(O)C(F)(F)F as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CC1=NN(C)C2=NC=C(C(N)=O)C(NCCN)=C12 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CN(C)C=O.NC1=NC=NC2=CC(CCl)=CC=C12.O=C1NCCN(CC=CC2=CC=C(Cl)C=C2)C1=O.[H-].[Na+] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be NC1=NC=NC2=CC(CN3CCN(CC=CC4=CC=C(Cl)C=C4)C(=O)C3=O)=CC=C12 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CC1=NN=C(C2=CC=C(C)C(C3=CC=C(C(=O)NCC4=CC=C(C(F)(F)F)C=C4)C=C3)=C2)O1.CCI as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CCN(CC1=CC=C(C(F)(F)F)C=C1)C(=O)C1=CC=C(C2=CC(C3=NN=C(C)O3)=CC=C2C)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1CCOC1.COC(=O)C1=C(C)CC(C)CC1=O.ClC1=CC=C([Mg]Br)C=C1Cl.[Cl-].[NH4+] ",
"input": "",
"output": " COC(=O)C1=C(C)CC(C)CC1(O)C1=CC=C(Cl)C(Cl)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(=O)N(C)C.CC1=CN=C(NC(=O)C2=CC(O)=CC(O[C@H]3CCN(C)C3=O)=C2)C=N1.O=C(C1=CC=C(F)C(Cl)=C1)N1CCC1.O=C([O-])[O-].[K+] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CC1=CN=C(NC(=O)C2=CC(OC3=CC=C(C(=O)N4CCC4)C=C3Cl)=CC(O[C@H]3CCN(C)C3=O)=C2)C=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " BrC1=CC=C2C=NNC2=C1.CCOCC.CI.CO.[K+].[OH-] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CN1N=CC2=CC=C(Br)C=C21 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC1=CC(O)=C(C)C(C)=C1O.CCOCC.ClCCCl.FB(F)F.O.O=C(O)CCCCCC(O)C1=CC=CC(C(F)(F)F)=C1 ",
"input": "",
"output": " CC1=C(C)C(=O)C(C(CCCCCC(=O)O)C2=CC=CC(C(F)(F)F)=C2)=C(C)C1=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC1=CC=C(CSC2=NC3=CSC=C3N2)N=C1.CN(C)C=O.COC1=CC=C(COC(=O)OC2=CC=CC=C2)C=C1.[H-].[Na+] ",
"input": "",
"output": " COC1=CC=C(COC(=O)N2C(SCC3=CC=C(C)C=N3)=NC3=CSC=C32)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CCON.CO.COC(=O)CC(=O)C1=CC=C(O)C=C1.Cl .",
"input": "",
"output": " CCON=C(CC(=O)OC)C1=CC=C(O)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC#N.CC(C)(C)OC(=O)N[C@@H](CC1=CC=C([N+](=O)[O-])C=C1)C(=O)O.CCN(C(C)C)C(C)C.CN(C)C(ON1N=NC2=CC=CC=C21)=[N+](C)C.COC1=CC=C(CN2C=CC(C)=C(N)C2=O)C=C1.Cl.F[B-](F)(F)F Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CCC(=O)NC1=C(C)C=CN(CC2=CC=C(OC)C=C2)C1=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C1CCOC1.C=C(NC(=O)OCC)NC1=NC=C(C2=CC=C3OCCN(C4=NC=NC5=C4CC(C)(C)CC5)CC3=C2)C=C1N.O=[Hg] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CCOC(=O)NC1=NC2=NC=C(C3=CC=C4OCCN(C5=NC=NC6=C5CC(C)(C)CC6)CC4=C3)C=C2N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCC1=C(B2OC(C)(C)C(C)(C)O2)C=CC=C1C1=CCN(CC2=CC=CC=C2)CC1.CCOC(C)=O.[Pd] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CCC1=C(B2OC(C)(C)C(C)(C)O2)C=CC=C1C1CCNCC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)(C)O.COC1=CN=C2C(OC3=CC=C(N)C=C3)=CC=NC2=C1.ClC1=NN=C(Cl)C2=CC=CC=C12 Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be COC1=CN=C2C(OC3=CC=C(NC4=NN=C(Cl)C5=CC=CC=C45)C=C3)=CC=NC2=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(=O)Cl.CN(C)C=O.O=C(NOC1CCCCO1)C1=CN=C(N2CCC3=C(C2)NC2=CC=CC=C32)N=C1.[H-].[Na+] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CC(=O)N1C2=C(CCN(C3=NC=C(C(=O)NOC4CCCCO4)C=N3)C2)C2=CC=CC=C21 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with B1C2CCCC1CCC2.C1CCOC1.C=CC1=COC(/C=C/C2=CC=CC=C2)=N1.CCOC(C)=O.O.OO.[Na+].[OH-] as the reactants and reagents.",
"input": "",
"output": " OCCC1=COC(/C=C/C2=CC=CC=C2)=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CCCCCCC.CCN(CC)CC.CCOC(=O)C[C@H]1CC[C@H](N)CC1.CCOC(C)=O.Cl.ClCCl.O=C(Cl)C1=CC=NC2=CC=CC=C12 ",
"input": "",
"output": " CCOC(=O)C[C@H]1CC[C@H](NC(=O)C2=CC=NC3=CC=CC=C23)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CC1=CC=C2C(C)=CNC2=C1.C[C@]1(C2=CC=CC=C2)NC(=O)C=C1O.O=CC1=CC=CC=C1 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CC1=CC=C2C(C)=C(C(C3=C(O)[C@@](C)(C4=CC=CC=C4)NC3=O)C3=CC=CC=C3)NC2=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C(=NC1CCCCC1)=NC1CCCCC1.CC(C)(C)OC(=O)NCCCN(CCCCN)C(=O)OC(C)(C)C.CCOC(=O)CC(=O)[O-].CCOC(C)=O.ClC(Cl)Cl .",
"input": "",
"output": " CCOC(=O)CC(=O)NCCCCN(CCCNC(=O)OC(C)(C)C)C(=O)OC(C)(C)C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1CCOC1.FC1=CC=C(CN2C=CC3=CC(OCC4=CC=CC=C4)=CC=C32)C=C1.O=C(Cl)C(=O)Cl as the reactants and reagents.",
"input": "",
"output": " O=C(Cl)C(=O)C1=CN(CC2=CC=C(F)C=C2)C2=CC=C(OCC3=CC=CC=C3)C=C12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using N#CC1(C(=O)O)CC1.NC1=CC=C(CCCCCCCCCC2=CC=CC=C2)C=C1 as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " N#CC1(C(=O)NC2=CC=C(CCCCCCCCCC3=CC=CC=C3)C=C2)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1COCCN1.CC(=O)O.CO.O=CC1=CC=CC(S(=O)(=O)C2=CC=C(/C=C/C3=CC=C(F)C=C3F)N=C2)=C1.[BH3-]C#N.[Na+].[OH-] as the reactants and reagents.",
"input": "",
"output": " O=S(=O)(C1=CC=C(/C=C/C2=CC=C(F)C=C2F)N=C1)C1=CC=CC(CN2CCOCC2)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. C=CCC1=CC(C2=NNC(=O)CC2)=CC=C1O.ClCC1CO1.ClCCl.O=C(O)CCC(=O)C1=CC=CC=C1O.[Na+].[OH-] ",
"input": "",
"output": " C=CCC1=CC(C2=NNC(=O)CC2)=CC=C1OCC1CO1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC(Br)C(=O)C1=CC=C(Cl)C=C1Cl.CCCN(C(N)=S)C(C1=CC=C(Br)C=C1)C1CC1.CCN(CC)CC.CCO ",
"input": "",
"output": " CCCN(C1=NC(C2=CC=C(Cl)C=C2Cl)=C(C)S1)C(C1=CC=C(Br)C=C1)C1CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " COC1=CC=C(C(=O)N2C3=CC=CC=C3C(N3C4=CC=CC=C4C4=CC=CC=C43)CC2CCCCCO)C=C1OC.FC(F)(F)C1=CC=CC(C2CCNCC2)=C1 Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be COC1=CC=C(C(=O)N2C3=CC=CC=C3C(N3C4=CC=CC=C4C4=CC=CC=C43)CC2CCCCCN2CCC(C3=CC=CC(C(F)(F)F)=C3)CC2)C=C1OC .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CCO.Cl.O.O=C(NNC1=NC=C(Br)N=C1Cl)C(F)(F)F.O=C([O-])O.[Na+] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " NNC1=NC=C(Br)N=C1Cl ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CC2(CCN1)OCCO2.COC1=CC(C2=CC(CCl)=CC=N2)=CC(OC)=C1Cl Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be COC1=CC(C2=CC(CN3CCC4(CC3)OCCO4)=CC=N2)=CC(OC)=C1Cl .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.CC(=O)[O-].CC(C)(C)C(=O)NC1=CC2=C(C=C1Br)S(=O)(=O)C1=CC=CC=C21.CCCCC.CI.ClCCl.[Li]C(C)(C)C.[NH4+] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CC1=CC2=C(C=C1NC(=O)C(C)(C)C)C1=CC=CC=C1S2(=O)=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C1=CC=NC=C1.CCOC(=O)C1=CC=CN=C1N.O=C(Cl)CC1=CC=CC(OC2=CC=CC=C2)=C1 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CCOC(=O)C1=CC=CN=C1NC(=O)CC1=CC=CC(OC2=CC=CC=C2)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses COCCNCCOC.FC1=CC=C(C2=CSC3=CC(OCCCCBr)=CC=C23)C=C1 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: COCCN(CCCCOC1=CC=C2C(C3=CC=C(F)C=C3)=CSC2=C1)CCOC .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CNC.O=C(NC1=NN2C(Cl)=CC(C(F)(F)F)=CC2=N1)C1=CC=CN=C1 as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CN(C)C1=CC(C(F)(F)F)=CC2=NC(NC(=O)C3=CC=CN=C3)=NN12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CO.COC(=O)CC1=C(OCC2=CC=CC=C2)C(C)=NN1C.[Pd] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: COC(=O)CC1=C(O)C(C)=NN1C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. ClC(Cl)Cl.O=C1CCC(=O)N1Br.O=[N+]([O-])C1=CC=C(OC2=CC=NN3C=CC=C23)C(F)=C1 ",
"input": "",
"output": " O=[N+]([O-])C1=CC=C(OC2=CC=NN3C=CC(Br)=C23)C(F)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC(C)(C)OC(=O)CNC(=O)C1=NC2=CC(Cl)=CC=C2O1.O=C(O)C(F)(F)F is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " O=C(O)CNC(=O)C1=NC2=CC(Cl)=CC=C2O1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC1=CC=CC=C1N.CCCCN(C1=CC=NC=C1)C1=NC(C2=CC(Br)=CC=C2F)=NC2=NC=CN=C12.O=C1NC(C2=CC(Br)=CC=C2F)=NC2=NC=CN=C12 .",
"input": "",
"output": " CC1=CC=CC=C1NC1=NC(C2=CC(Br)=CC=C2F)=NC2=NC=CN=C12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1COCCO1.CC(=O)NC1(CCC2=CC=C(C3=CC=C(Br)C=C3F)C=C2)COC(C)(C)OC1.CC1(C)C2=CC=CC(P(C3=CC=CC=C3)C3=CC=CC=C3)=C2OC2=C(P(C3=CC=CC=C3)C3=CC=CC=C3)C=CC=C21.CCN(C(C)C)C(C)C.ClC(Cl)Cl.O.O=C(/C=C/C1=CC=CC=C1)/C=C/C1=CC=CC=C1.SC1=CC=CC=C1.[Pd] ",
"input": "",
"output": " CC(=O)NC1(CCC2=CC=C(C3=CC=C(SC4=CC=CC=C4)C=C3F)C=C2)COC(C)(C)OC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=C(C2=CC=C3C[C@@H]4NCCC[C@@H]4C3=C2)CCOC1.O=C(O)C1=CC=C2NC=NC2=C1 Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " O=C(C1=CC=C2N=CNC2=C1)N1CCC[C@@H]2C3=CC(C4=CCOCC4)=CC=C3C[C@@H]21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: COC[C@H](N)C(=O)OC.Cl.O=C(O)C1=CC(C2=CC=CC(NC3=NC4=CC=C(F)C=C4S3)=C2)=NO1 .",
"input": "",
"output": " COC[C@H](NC(=O)C1=CC(C2=CC=CC(NC3=NC4=CC=C(F)C=C4S3)=C2)=NO1)C(=O)OC ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C1COCCO1.CC(C)(C)OC(=O)/C=C/C1=C(N2CCCC(OC(N)=O)C2)N=C2C=C(C(=O)NC3=NC(C4CCC4)=CS3)C=CN2C1=O.Cl , what product could potentially be produced?",
"input": "",
"output": "The product can be NC(=O)OC1CCCN(C2=C(/C=C/C(=O)O)C(=O)N3C=CC(C(=O)NC4=NC(C5CCC5)=CS4)=CC3=N2)C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1CCOC1.CO.ClCCl.NC(=O)C1=C(N)C2=C(OS(=O)(=O)C(F)(F)F)C=CN=C2S1.NC1=CC=CC=C1 ",
"input": "",
"output": " NC(=O)C1=C(N)C2=C(NC3=CC=CC=C3)C=CN=C2S1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)(C)C1=CC=C(C(=O)O)C(CC(=O)O)=C1.NC(N)=O Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CC(C)(C)C1=CC=C2C(=O)NC(=O)CC2=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: B.C1CCOC1.CC(C)N(CC1=CC=C(C#N)C=C1)C(=O)OC(C)(C)C.CO.CSC.O=S(=O)([O-])O.[K+].[Na+].[OH-] , what product could potentially be produced?",
"input": "",
"output": "The product can be CC(C)N(CC1=CC=C(CN)C=C1)C(=O)OC(C)(C)C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC1=C(CCl)OC2=CC=C([N+](=O)[O-])C=C12.CCO.CNCCC1=CC=C(NS(C)(=O)=O)C=C1 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC1=C(CN(C)CCC2=CC=C(NS(C)(=O)=O)C=C2)OC2=CC=C([N+](=O)[O-])C=C12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CN(C)C=O.COC(=O)CN1C=CC=C1C=CC1=CC=CC=C1.COC=O.O=C([O-])O.[H-].[Na+] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " COC(=O)C(=CO)N1C=CC=C1/C=C/C1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC(C)(C)OC(=O)N1CCC(CN)(C2=CC=CC=C2)CC1.CCN(C(C)C)C(C)C.CCN=C=NCCCN(C)C.CN1CCCC1=O.O.O=C(O)C1=NC=CC(SC2=CN=C(NC3=CC=CC=N3)S2)=C1F.ON1N=NC2=CC=CC=C21 ",
"input": "",
"output": " CCCCOC(=O)N1CCC(CNC(=O)C2=NC=CC(SC3=CN=C(NC4=CC(C)=CC=N4)S3)=C2F)(C2=CC=CC=C2)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. BrC1=CNC=N1.C1CCOC1.CCCCC.COC1=CC=C(C2=CC=CC=C2)C=C1C=O.[Cl-].[Li]C(C)(C)C.[NH4+] ",
"input": "",
"output": " COC1=CC=C(C2=CC=CC=C2)C=C1C(O)C1=CNC=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CCO.CCOC(=O)N1N=C(OC)C2=CC=C(C(=O)OC)C=C21.[K+].[OH-] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: COC1=NNC2=CC(C(=O)O)=CC=C12 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CCN(C(C)C)C(C)C.CCOC(C)=O.CN(C)C(ON1N=NC2=CC=CC=C21)=[N+](C)C.CN(C)C=O.COC(=O)C1(C(=O)O)CC1.F[B-](F)(F)F.NC1=CC=C(F)C=C1 as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " COC(=O)C1(C(=O)NC2=CC=C(F)C=C2)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC(C)CO.ClC1=NSN=C1C1=CC=CN=C1.[NaH] .",
"input": "",
"output": " CC(C)COC1=NSN=C1C1=CC=CN=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1CCOC1.C1COCCN1.COC(=O)C1=CN2N=C(C3=CC=C([N+](=O)[O-])C=C3)N=C(Cl)C2=C1 ",
"input": "",
"output": " COC(=O)C1=CN2N=C(C3=CC=C([N+](=O)[O-])C=C3)N=C(N3CCOCC3)C2=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C[C@@H](N)CO.NC1=CN=C(C2=CC=C(C3=CC=CC=C3C(=O)O)C=C2F)C=N1 Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be C[C@H](CO)NC(=O)C1=CC=CC=C1C1=CC=C(C2=CN=C(N)C=N2)C(F)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC1=CC=C(NC(=O)C2=CC=CC(N(C)C)=C2)C=C1NC(=O)C1=CC=CC(OCC(=O)OC(C)(C)C)=C1.ClCCl.O=C(O)C(F)(F)F Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CC1=CC=C(NC(=O)C2=CC=CC(N(C)C)=C2)C=C1NC(=O)C1=CC=CC(OCC(=O)O)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CC=C(P(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.CC1=CC=CC=C1.FC1=CC=C(CCBr)C=C1 Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be FC1=CC=C(CC[P+](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.[Br-] .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1=CC=C([PH](C2=CC=CC=C2)(C2=CC=CC=C2)[Pd]([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)[PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.CC(=O)N1C2=CC=C(Br)C=C2C(NC2=CC=C(Cl)C=C2)CC1C.CCCC[Sn](CCCC)(CCCC)C1=CN=C(C)N1COCC[Si](C)(C)C.CN(C)C=O ",
"input": "",
"output": " CC(=O)N1C2=CC=C(C3=CN=C(C)N3COCC[Si](C)(C)C)C=C2C(NC2=CC=C(Cl)C=C2)CC1C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC1=CC=C(C2(O)C(=O)NC3=CC(Cl)=CC=C32)C=C1C.CCOC(C)=O.CC[SiH](CC)CC.O=C(O)C(F)(F)F.O=C([O-])[O-].[Na+] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC1=CC=C(C2C(=O)NC3=CC(Cl)=CC=C32)C=C1C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CCO.CN.O=C1C2=CC=CC=C2C(=O)N1CC1=CC=C(OCC2=NC([C@@H]3CCCCN3S(=O)(=O)C3=NC4=CC=CC=C4N3)=NO2)C=C1 ",
"input": "",
"output": " NCC1=CC=C(OCC2=NC([C@@H]3CCCCN3S(=O)(=O)C3=NC4=CC=CC=C4N3)=NO2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CC=C([PH](C2=CC=CC=C2)(C2=CC=CC=C2)[Pd]([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)[PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.CC(C)(C)C1=CC(B(O)O)=CC=C1N1CCCC1.CCOC(=O)C1=CC=C(C2=CC=C(O)C(Br)=C2)C=C1.CCOC(=O)C1=CC=C(C2=CC=C(O)C(C3=CC=C(N4CCCC4)C(C(C)(C)C)=C3)=C2)C=C1.O=C([O-])[O-].[K+] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CCOC(=O)C1(O)C=CC(C2=CC=CC(C3=CC=C(N4CCCC4)C(C(C)(C)C)=C3)=C2)=CC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CC=C(P(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.C1CCOC1.CCOC(=O)C1=CC=CC=C1CBr Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CCOC(=O)C1=CC=CC=C1C[P+](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1.[Br-] ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC1(C)[C@H]2CC[C@]1(C)C(=O)C2=O.COP(=O)(CC(=O)CCC(C)(C)C)OC.NN.O ",
"input": "",
"output": " CC(C)(C)CCC1=CC2=C(N=N1)[C@@]1(C)CC[C@@H]2C1(C)C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCCC(C(=O)OC)C1=C(C)N=C(C2=CC=CC=C2)N=C1C1=CC=CC(OCOC)=C1.CO.Cl.[Na+].[OH-] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CCCC(C(=O)O)C1=C(C)N=C(C2=CC=CC=C2)N=C1C1=CC=CC(O)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C1CCOC1.CCCCCCC.CCOC(C)=O.CN1N=CC=C1C1=CC(C(F)(F)F)=CC=C1C1=CN(C)C2=CC(S(=O)(=O)OC3=C(F)C(F)=C(F)C(F)=C3F)=CC=C12.COC1=CC=C(CNC2=NC(Br)=NS2)C=C1.C[Si](C)(C)[N-][Si](C)(C)C.[Li+] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: COC1=CC=C(CN(C2=NC(Br)=NS2)S(=O)(=O)C2=CC=C3C(C4=CC=C(C(F)(F)F)C=C4C4=CC=NN4C)=CN(C)C3=C2)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC1=CC=CC(SC2=CC3=C(C=C2Cl)NC(N2C=C(C(=O)O)C=N2)=N3)=C1.CCOC(=O)C1=CN(C2=NC3=CC(SC4=CC=CC(C)=C4)=C(Cl)C=C3N2COCCOC)N=C1.CO.ClCCl.O.O=C([O-])O.O=S([O-])([O-])=S.O=S([O-])OO.[K+].[Na+] ",
"input": "",
"output": " CCOC(=O)C1=CN(C2=NC3=CC(S(=O)(=O)C4=CC=CC(C)=C4)=C(Cl)C=C3N2COCCOC)N=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CCCC[N+](CCCC)(CCCC)CCCC.COC(C)(C)C.FC(F)(F)C(F)(I)C(F)(F)F.NC1=CC=CC=C1.O.O=C([O-])O.O=S(=O)([O-])O.O=S([O-])([O-])=S.[Na+] ",
"input": "",
"output": " NC1=CC=C(C(F)(C(F)(F)F)C(F)(F)F)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CC(=O)O.CCO.COCN1C(C)=NC2=C(OCC3=CC=CC=C3)C=C(C(=O)N(C)C)C=C21.[Pd] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " COCN1C(C)=NC2=C(O)C=C(C(=O)N(C)C)C=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C=O.CC(C)O.CCC1=NC(C)=CN1.OC1=CC=C2C=CC=CC2=C1 as the reactants and reagents.",
"input": "",
"output": " CCC1=NC(C)=C(CC2=C(O)C=CC3=CC=CC=C23)N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CO.COC(=O)C1=CC(OC)=CC([N+](=O)[O-])=C1N.[H][H].[Pd] ",
"input": "",
"output": " COC(=O)C1=CC(OC)=CC(N)=C1N ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if NC1=CC=NC=C1.O=C(Cl)C1=CC=CC(Cl)=C1 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " O=C(NC1=CC=NC=C1)C1=CC=CC(Cl)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. C1=CC=C(P(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.C1CCOC1.CC(C)OC(=O)/N=N/C(=O)OC(C)C.O=C1NN=C2C=CC(Br)=CN12.OCCC1=CC=C2C=CC=CC2=N1 ",
"input": "",
"output": " O=C1N(CCC2=CC=C3C=CC=CC3=N2)N=C2C=CC(Br)=CN12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC(C)O.CC1(C)C[C@H](NC2=NC(Cl)=NC=C2C#N)C[C@@H]2CCCN21.CN1N=NN(C2=CC(N)=C(F)C=C2O)C1=O.O=S(=O)(O)C1=CC=CC=C1 , what product could potentially be produced?",
"input": "",
"output": "The product can be CN1N=NN(C2=CC(NC3=NC=C(C#N)C(N[C@@H]4C[C@@H]5CCCN5C(C)(C)C4)=N3)=C(F)C=C2O)C1=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)(CO)NC(=O)C1=CC=CC=C1.N#CC1=C([N+](=O)[O-])C=CC=C1[N+](=O)[O-] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CC(C)(COC1=CC=CC([N+](=O)[O-])=C1C#N)NC(=O)C1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CN(C)C(=O)[C@@H]1CCCCN1C(=O)OCC1=CC=CC=C1.CO.Cl Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CN(C)C(=O)[C@@H]1CCCCN1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1CCOC1.CN(C)C=O.C[C@@H](OCC1=CC=CC=C1)[C@H](NC(=O)OC(C)(C)C)C(=O)O.Cl.O=C(OCC1=CC=CC=C1)[C@@H]1CCCN1.ON1N=NC2=CC=CC=C21 ",
"input": "",
"output": " C[C@@H](OCC1=CC=CC=C1)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@H]1C(=O)OCC1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. C1CCOC1.CO.FC(F)OC1=CC=CC(C#CC2=CC(OCC3=CC=CC=C3)=C(OCC3=CC=CC=C3)N=N2)=C1.O=C1NN=C(CCC2=CC=CC=C2)C=C1O ",
"input": "",
"output": " O=C1NN=C(CCC2=CC=CC(OC(F)F)=C2)C=C1O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C1CCOC1.CC(C)[Mg]Br.CC1=CC=NC(C)=C1C=O.COCN(C1=CC(Cl)=CN=C1Br)S(=O)(=O)C1=CC=C(Cl)C(C(F)(F)F)=C1.[Cl-].[NH4+] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " COCN(C1=CC(Cl)=CN=C1C(O)C1=C(C)C=CN=C1C)S(=O)(=O)C1=CC=C(Cl)C(C(F)(F)F)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C1CCOC1.COC(=O)CC1=CC=C(OCC2=CC=CC=C2)C=C1.C[Si](C)(C)C(F)(F)F.Cl.[Cs+].[F-] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: O=C(CC1=CC=C(OCC2=CC=CC=C2)C=C1)C(F)(F)F .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1CCOC1.C[C@H]1CC[C@H](C(=O)N(C2=C(C(=O)O)SC(C3=CCC4(CC3)OCCO4)=C2)[C@H]2CC[C@H](O)CC2)CC1.Cl.ClCCl ",
"input": "",
"output": " C[C@H]1CC[C@H](C(=O)N(C2=C(C(=O)O)SC(C3=CCC(=O)CC3)=C2)[C@H]2CC[C@H](O)CC2)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. C=CCBr.CN(C)C=O.CN1C(=O)C2=C(N=C(Cl)N2)N(C)C1=O.O=C([O-])[O-].[K+] ",
"input": "",
"output": " C=CCN1C(Cl)=NC2=C1C(=O)N(C)C(=O)N2C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C.C=CC1=CC=C(C(=O)OC)C(O)=C1.CCO.[Pd] ",
"input": "",
"output": " CCC1=CC=C(C(=O)OC)C(O)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCC(CC)NC1=NC(Cl)=NC=C1N.CCOC(C)=O.CN(C)C=O.O=C(N1C=CN=C1)N1C=CN=C1 Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CCC(CC)N1C(=O)NC2=CN=C(Cl)N=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CS(=O)(=O)C1=NC2=NC(C3=CC=CO3)=NN2C(N)=N1.CS(C)=O.OC[C@@H]1CC[C@H]2CNCCN2C1 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: NC1=NC(N2CCN3CC(CO)CCC3C2)=NC2=NC(C3=CC=CO3)=NN12 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C1CCOC1.CO.COC(=O)[C@H](C)N(CC1=CC=CC=C1)C1=CC=C(F)C(Cl)=C1.O.[Li]O as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: C[C@@H](C(=O)[O-])N(CC1=CC=CC=C1)C1=CC=C(F)C(Cl)=C1.[Li+] .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1=CC=CC=C1.CCOCC.CC[C@@H](CN(C)S(=O)(=O)C1CC1)N1C(=O)[C@@](C)(CC(=O)O)C[C@H](C2=CC=CC(Cl)=C2)[C@H]1C1=CC=C(Cl)C=C1.CO.C[Si](C)(C)C=[N+]=[N-] ",
"input": "",
"output": " CC[C@@H](CN(C)S(=O)(=O)C1CC1)N1C(=O)[C@@](C)(CC(=O)OC)C[C@H](C2=CC=CC(Cl)=C2)[C@H]1C1=CC=C(Cl)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CO.COC1=CC=CC(C2(N(C)C)CCC(C(=O)CC3=CC=CC=C3)CC2)=C1.O.[BH4-].[Na+] .",
"input": "",
"output": " COC1=CC=CC(C2(N(C)C)CCC(C(O)CC3=CC=CC=C3)CC2)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CCOC(C)=O.COC(=O)[C@H](CC1=CC=C(C2=CC=NC(C)=C2C)C=C1)NC(=O)[C@@H]1CC2=CC3=C(C=C2CN1)O[C@@H](C1=CC=C(OCC2CCCCC2)C=C1)CO3.Cl.O=C(Cl)C1=CC=CC=C1.O=C([O-])O.[Na+] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CC1=NC=CC(C2=CC=C(C[C@H](NC(=O)[C@@H]3CC4=CC5=C(C=C4CN3C(=O)C3=CC=CC=C3)O[C@@H](C3=CC=C(OCC4CCCCC4)C=C3)CO5)C(=O)O)C=C2)=C1C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. C1=CC=C([PH](C2=CC=CC=C2)(C2=CC=CC=C2)[Pd]([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)[PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.C1COCCO1.CC1=CC=C(C(=O)O)C=C1B1OC(C)(C)C(C)(C)O1.CSC1=NC(Cl)=C2CNC(=O)N(C3=C(F)C=CC=C3F)C2=N1.O.O=C([O-])[O-].[K+] ",
"input": "",
"output": " CSC1=NC(C2=CC(C(=O)O)=CC=C2C)=C2CNC(=O)N(C3=C(F)C=CC=C3F)C2=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C1CN[C@H](CN2CCCC2)C1.CC(C)C(=O)C1=CC=C(C2=CC=C(C(=O)O)C=C2)S1.CCN(C(C)C)C(C)C.CCN=C=NCCCN(C)C.CN(C)C=O.Cl.ClCCl.ON1N=NC2=CC=CC=C21.[LiH] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CC(C)C(=O)C1=CC=C(C2=CC=C(C(=O)N3CCC[C@H]3CN3CCCC3)C=C2)S1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C1=CC=C(P(C2=CC=CC=C2)[C-]2C=CC=C2)C=C1.CC(=O)[O-].CCCN1C=C(N2C(Br)=C(SC3=CC=CC(C(=O)OCC)=C3F)C3=CC=C(Cl)C(F)=C32)C=N1.COCCOC.Cl[Pd]Cl.O.OB(O)C1CC1.[Fe+2].[K+] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CCCN1C=C(N2C(C3CC3)=C(SC3=CC=CC(C(=O)OCC)=C3F)C3=CC=C(Cl)C(F)=C32)C=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1COCCO1.C=O.CNC[C@H](CSC)[C@@H]1COC(C)(C)O1.CO.N.NC1=NC=NC2=C1N=CC2.O Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CSC[C@@H](CN(C)CC1=CNC2=C(N)N=CN=C12)[C@@H]1COC(C)(C)O1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C1CCOC1.CCI.COC1(OC)CCOCC1O.[H-].[Na+] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CCOC1COCCC1(OC)OC ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC(=O)[O-].CC(C)=O.CCC=C(C)C=O.O.[Zn+2] as the reactants and reagents.",
"input": "",
"output": " CCC=C(C)C=CC(C)=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC(=O)[O-].CC1=NC2=C(C(=O)O)C=CC=C2C(=O)O1.CO.[NH4+].[OH-] .",
"input": "",
"output": " CC1=NC2=C(C(=O)O)C=CC=C2C(=O)N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " O=[N+]([O-])C1=CC=C(S(=O)(=O)OC[C@@H]2CO2)C=C1.OC1=CC=CC2=C1OC(C1=NN=C(C(F)(F)F)O1)=C2 Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be FC(F)(F)C1=NN=C(C2=CC3=CC=CC(OC[C@@H]4CO4)=C3O2)O1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1=CC=C(CCCN2CCNCC2)C=C1.O=[N+]([O-])C1=CC=CC(S(=O)(=O)OCC2CO2)=C1 ",
"input": "",
"output": " C1=CC=C(CCCN2CCN(CC3CO3)CC2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(=O)O.COC(=O)C1=CC=C2C(=C1)S(=O)(=O)CC1=CC=CC=C1C2O.[H][H].[O-][Cl+3]([O-])([O-])O.[Pd] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " COC(=O)C1=CC=C2CC3=CC=CC=C3CS(=O)(=O)C2=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " II.O=C(NC1=NC(C2=CC=CO2)=C(Br)S1)C1=CC=CC=C1 Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be O=C(NC1=NC(C2=CC=CO2)=C(I)S1)C1=CC=CC=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C1=CC=C([PH](C2=CC=CC=C2)(C2=CC=CC=C2)[Pd-4]([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)[PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.C1COCCO1.CC1(C)OB(C2=CCC3(CC2)OCCO3)OC1(C)C.N#CCC1=CC=C(Br)C=C1.O=C([O-])[O-].[Na+] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: N#CCC1=CC=C(C2=CCC3(CC2)OCCO3)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C1CCOC1.CC(C)(C)OC(=O)N[C@@H](CCC(N)=O)C(=O)O.O=C(C1=NC=CN1)C1=NC=CN1 .",
"input": "",
"output": " CC(C)(C)OC(=O)NC1CCC(=O)NC1=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C1=CC=NC=C1.CC(C)C(=O)Cl.CCOC(C)=O.CC[C@H](O)[C@@H]1C[C@H]2OC(C)(C)O[C@H]2O1 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CC[C@H](OC(=O)C(C)C)[C@@H]1C[C@H]2OC(C)(C)O[C@H]2O1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses O=C(O)C(F)(F)F.O=[Pt]=O.OC1=NC(O)=C2C=CC=CC2=N1 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: OC1=NC(O)=C2CCCCC2=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CCN(C(C)=O)C1=CC=CC(C2=CC=NC3=CC=NN23)=C1.ClCCl.ClN1N=NC2=CC=CC=C21 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CCN(C(C)=O)C1=CC=CC(C2=CC=NC3=C(Cl)C=NN23)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1CCOC1.CC(=O)N(C)C.CC1=NN(C)C(C(=O)O)=C1.CN(C)C=O.NC1=CC=CC(OC2=NN3C=C(CCC(=O)NC=O)N=C3C=C2)=C1.O=C(Cl)C(=O)Cl ",
"input": "",
"output": " CCC(=O)NC1=CN2N=C(OC3=CC=CC(NC(=O)C4=CC(C)=NN4C)=C3)C=CC2=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using COC(=O)C[C@@H]1COC2=CC(O[C@@H]3CCC4=C(O)C=CC(F)=C43)=CC=C21.N#CC1=CC=C(F)C=C1 as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " COC(=O)C[C@@H]1COC2=CC(O[C@@H]3CCC4=C(OC5=CC=C(C#N)C=C5)C=CC(F)=C43)=CC=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C=C(CCCCCl)C(=O)C1=CC=C(OC)C(Cl)=C1Cl.C=O.CC(=O)O.CN(C)C=O.CNC.COC1=CC=C(C(=O)CCCCCBr)C(Cl)=C1Cl.Cl.O.O=S(=O)(O)O as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: COC1=CC2=C(C(=O)C(CCCCCl)C2)C(Cl)=C1Cl .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CCOC(C)=O.COC(=O)C1=CC(=O)N(CCN2CCC(N(CC3=CC=C4OCCOC4=C3)C(=O)OC(C)(C)C)CC2)C2=CC=CC=C12.Cl ",
"input": "",
"output": " COC(=O)C1=CC(=O)N(CCN2CCC(NCC3=CC=C4OCCOC4=C3)CC2)C2=CC=CC=C12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) NC1=CC=C2N=C(NCCOC3=CC=CC=C3)OCC2=C1.O=C(Cl)CCl as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: O=C(CCl)NC1=CC=C2N=C(NCCOC3=CC=CC=C3)OCC2=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. C1=CC=C(P(C2=CC=CC=C2)[C-]2C=CC=C2)C=C1.C1CCOC1.CC#N.C[C@@H](NC(=O)[C@H](CC1=CC=C(C2=NC=C(Br)C=N2)C=C1)NC(=O)C1=CC=C(C(C)(C)C)C=C1)C(=O)OC(C)(C)C.Cl[Pd]Cl.O.O=C([O-])[O-].OB(O)C1=CC=C(O)C=C1.[Fe+2].[Na+] ",
"input": "",
"output": " C[C@@H](NC(=O)[C@H](CC1=CC=C(C2=NC=C(C3=CC=C(O)C=C3)C=N2)C=C1)NC(=O)C1=CC=C(C(C)(C)C)C=C1)C(=O)OC(C)(C)C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC(=O)O.CC(=O)O[BH-](OC(C)=O)OC(C)=O.CC(C)CC=O.ClCCCl.N#CC1=CC=C(C2=CSC(N)=N2)C=C1.[Na+] , what product could potentially be produced?",
"input": "",
"output": "The product can be CC(C)CCNC1=NC(C2=CC=C(C#N)C=C2)=CS1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C1CCOC1.CC1=CC(N2CCC(C#N)(NC3=NN4C=CC=C(C5=CC=C(F)C(F)=C5)C4=N3)CC2)=NC=N1.C[Mg]Br as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CC1=CC(N2CCC(C)(NC3=NN4C=CC=C(C5=CC=C(F)C(F)=C5)C4=N3)CC2)=NC=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CC#CCN1C(N2CCC[C@@H](NC(=O)OC(C)(C)C)C2)=NC2=C1C(=O)NN(C)C2=O.CC1=CC2=CC=CC=C2C(CCl)=N1.CN(C)C=O.O.O=C([O-])[O-].[K+] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CC#CCN1C(N2CCC[C@@H](NC(=O)OC(C)(C)C)C2)=NC2=C1C(=O)N(CC1=NC(C)=CC3=CC=CC=C13)N(C)C2=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CCC1=CC=CC=C1N=C=S.CCN(CC)CC.CCNCC(=O)O.ClC(Cl)Cl ",
"input": "",
"output": " CCC1=CC=CC=C1N1C(=O)CN(CC)C1=S ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C1=CC=C([C@@H]2CO2)C=C1.CC#N.NCCCC1=CC=C(S(N)(=O)=O)C=C1 .",
"input": "",
"output": " NS(=O)(=O)C1=CC=C(CCCNC[C@H](O)C2=CC=CC=C2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CCO.O=C([O-])C=CCCCCCC1=NC=C(C2=CC=CC=C2)C(C2=CC=CC=C2)=N1.[Pd] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " O=C(O)CCCCCCCC1=NC=C(C2=CC=CC=C2)C(C2=CC=CC=C2)=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC(=O)O.CC(=O)O[BH-](OC(C)=O)OC(C)=O.CC(C)OC1=CC=C(C2=NC(C3=CC=CC4=C3NC=C4C=O)=NO2)C=C1C#N.CNCC(=O)O.ClCCl.[Na+] .",
"input": "",
"output": " CC(C)OC1=CC=C(C2=NC(C3=CC=CC4=C3NC=C4CN(C)CC(=O)O)=NO2)C=C1C#N ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CC1=CC(C(=O)O)=CC=C1C1=CC=NC=C1.NC1=CC=C2C=CC=NC2=C1 as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CC1=CC(C(=O)NC2=CC=C3C=CC=NC3=C2)=CC=C1C1=CC=NC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC(C)(C)OC(=O)NCC1=CC=CC(CN)=C1.CC1=C(C)N(CC2=CC=C(C3=CC=CC=C3C(=O)OC(C)(C)C)C=C2)C2=CC=C(C(=O)O)C=C12 ",
"input": "",
"output": " CC1=C(C)N(CC2=CC=C(C3=CC=CC=C3C(=O)O)C=C2)C2=CC=C(C(=O)NCC3=CC=CC(CN)=C3)C=C12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC(C)(C)OC(=O)NCC#N.CO.CO[Na].Cl.NC1=CC=CC=C1N.O , what product could potentially be produced?",
"input": "",
"output": "The product can be CC(C)(C)OC(=O)NCC1=NC2=CC=CC=C2N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C1COCCN1.CCC(C)CCCNC(=O)C1=CN=C(OCC2CO2)S1.CCO.NC(=O)C1=CN=C(OCC2CO2)S1 , what product could potentially be produced?",
"input": "",
"output": "The product can be CCC(C)CCCNC(=O)C1=CN(N2CCOCC2)C(OCC(C)O)S1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C=CCNC(=O)CC1=CNC=N1.CS(=O)(=O)NN1C(=O)NC2=CC([N+](=O)[O-])=C(F)C=C2C1=O ",
"input": "",
"output": " C=CCNC(=O)CC1=CN(C2=CC3=C(C=C2[N+](=O)[O-])NC(=O)N(NS(C)(=O)=O)C3=O)C=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " COC(=O)C1=CC(NS(C)(=O)=O)=CC=C1/C=C/C1=CC(C2=CC=C(OC)NC2=O)=CC(C(C)(C)C)=C1OC.O.[Li]O Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be COC1=CC=C(C2=CC(/C=C/C3=CC=C(NS(C)(=O)=O)C=C3C(=O)O)=C(OC)C(C(C)(C)C)=C2)C(=O)N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC(C)C(=O)Cl.CN(C)C=O.C[O-].ClCCl.O=C([O-])O.[C-]#[N+]CC(=O)OC.[Na+] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: COC(=O)C1=C(C(C)C)OC=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC(C)(C)OC(=O)N1CCC(N)CC1.CCN=C=NCCCN(C)C.C[C@@H](OCC1=CC=CC=C1)C(=O)O.Cl.ClCCl.O.ON1N=NC2=CC=CC=C21 , what product could potentially be produced?",
"input": "",
"output": "The product can be C[C@@H](OCC1=CC=CC=C1)C(=O)NC1CCN(C(=O)OC(C)(C)C)CC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC#N.FC1=CC=C(CCBr)C=C1.NC(=O)C(C1=CC=CC=C1)(C1=CC=CC=C1)C1CCNC1.O.O=C([O-])[O-].[K+] ",
"input": "",
"output": " NC(=O)C(C1=CC=CC=C1)(C1=CC=CC=C1)C1CCN(CCC2=CC=C(F)C=C2)C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C#C[C@]1(O)CC2(OCCO2)C2=NOC=C2/C1=C\\C(=O)OC.CC1=CC=CC(C)=N1.CC[Si](CC)(CC)OS(=O)(=O)C(F)(F)F.CO.ClCCl.O.[Cl-].[Na+] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " C#C[C@]1(O[Si](CC)(CC)CC)CC2(OCCO2)C2=NOC=C2/C1=C\\C(=O)OC ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C1CCOC1.CC(C)(C)OC(=O)OCCl.CCCC1=NC(CC)=C(C(=O)[O-])N1CC1=CC=C(C2=CC=CC=C2C2=NN=NN2C(C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.CCCC[N+](CCCC)(CCCC)CCCC.CCN(CC)CC.[I-] , what product could potentially be produced?",
"input": "",
"output": "The product can be CCCC1=NC(CC)=C(C(=O)OCOC(=O)OC(C)(C)C)N1CC1=CC=C(C2=CC=CC=C2C2=NN=NN2C(C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC(=O)OCC1=C(C2=CN(C)C(=O)C(NC3=CC=C4CN(C(=O)OC(C)(C)C)CCC4=C3)=N2)C=C(F)C=C1N1CCN2C(=CC3=C2CCCC3)C1=O.CC(C)(C)OC(=O)N1CC2=CC=C(N)C=C2C1.CN1C=C(Br)N=C(Br)C1=O , what product could potentially be produced?",
"input": "",
"output": "The product can be CN1C=C(Br)N=C(NC2=CC=C3CN(C(=O)OC(C)(C)C)CC3=C2)C1=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC(=O)C1=NN2C(C(C)C3=C(F)C=C4C(=C3F)C=NN4C)=CN=C2C=C1.CO.NOCCO as the reactants and reagents.",
"input": "",
"output": " C/C(=N\\OCCO)C1=NN2C(C(C)C3=C(F)C=C4C(=C3F)C=NN4C)=CN=C2C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C1CCOC1.CC(C)(O)CN1CC2=CC(Br)=CC=C2C1=O.O.[H-].[Na+] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CC(=O)OC(C)(C)CN1CC2=CC(Br)=CC=C2C1=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC(=O)N(C(C)C)C1CCN(C(=O)OC(C)(C)C)CC1.Cl ",
"input": "",
"output": " CC(=O)N(C(C)C)C1CCNCC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1CCOC1.CC(C)(O)CN1C=CC(NC(=O)C(CC2CCCC2)N2N=CC(SC3=CC=CC=C3)=CC2=O)=N1.O=C(OO)C1=CC=CC(Cl)=C1 ",
"input": "",
"output": " CC(C)(O)CN1C=CC(NC(=O)C(CC2CCCC2)N2N=CC(S(=O)C3=CC=CC=C3)=CC2=O)=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.CC(C)C#N.CC(C)NC(C)C.CCCCCC.C[Si](C)(C)Cl.[Li]CCCC Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CC(C)(C#N)[Si](C)(C)C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: COC1(OC)C[C@@H](C(=O)O)N(C(=O)C(CSC(C)=O)C(F)(F)F)C1.N .",
"input": "",
"output": " COC1(OC)C[C@@H](C(=O)O)N(C(=O)C(CS)C(F)(F)F)C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CC=C(CC2CCNCC2)C=C1.CCC(C)=O.COC(=O)C1=CC(C(=O)C(C)Br)=CC=C1O.O=C([O-])[O-].[K+] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be COC(=O)C1=CC(C(=O)C(C)N2CCC(CC3=CC=CC=C3)CC2)=CC=C1O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCOC(=O)C1=CN=C2SC(CN3CCOCC3)=C(C)C2=C1O.CI.CN(C)C=O.O.O=C([O-])[O-].[K+] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CCOC(=O)C1=CN(C)C2=C(C(C)=C(CN3CCOCC3)S2)C1=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCN(CC)CC.CN(C)C=O.O=C(O)C1=CN(C2CC2)C2=NC(N3CC4CCC3CN4)=C(F)C=C2C1=O.OCCBr Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be Br.O=C(O)C1=CN(C2CC2)C2=NC(N3CC4CCC3CN4CCO)=C(F)C=C2C1=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C=CCN.CCO.COC1=CC(C=O)=C([N+](=O)[O-])C=C1OC Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be COC1=CC(C=C=CCN)=C([N+](=O)[O-])C=C1OC .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CCO.CCOCC.N#CN.NC1=CC=CC(F)=C1.O=[N+]([O-])O is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " NC(=O)NC1=CC=CC(F)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: Br.CCN(CC)CC.CCOC(=O)CN.CN(C)C=O.Cl.NC1=NC=C(Br)C=C1CBr.O .",
"input": "",
"output": " CCOC(=O)CNCC1=CC(Br)=CN=C1N ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CC(C)(C)OC(=O)NC1(C2=CC=C(C(=O)CC3=CC=CC=C3)C=C2)CCC1.COC(OC)N(C)C as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CN(C)C=C(C(=O)C1=CC=C(C2(NC(=O)OC(C)(C)C)CCC2)C=C1)C1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CCOC1=CC=C([Si](C)(C)COC(C)=O)C=C1.CCOCC.O.O=S(=O)(O)O.[Al+3].[H-].[Li+].[Na+].[OH-] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CCOC1=CC=C([Si](C)(C)CO)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CCO.CCOC(=O)C1=CC=CC(C2=CCN(C(=O)OC(C)(C)C)CC2)=C1.[Pd] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CCOC(=O)C1=CC=CC(C2CCN(C(=O)OC(C)(C)C)CC2)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " BrBr.CC(=O)O.CC(=O)[O-].CCC1=NC2=CC=CC(C)=C2C(=O)N1C1=CC=C(F)C=C1.O.[Na+] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CC1=CC=CC2=C1C(=O)N(C1=CC=C(F)C=C1)C(C(C)Br)=N2 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC1=CC=C(N)C=C1F.CCOC1=CC(C(C)(C)C)=NC=C1C1=N[C@@](C)(C2=CC=C(Cl)C=C2)[C@@](C)(C2=CC=C(Cl)C=C2)N1C(=O)N1CCC(CC(=O)O)CC1 ",
"input": "",
"output": " CCOC1=CC(C(C)(C)C)=NC=C1C1=N[C@@](C)(C2=CC=C(Cl)C=C2)[C@@](C)(C2=CC=C(Cl)C=C2)N1C(=O)N1CCC(CC(=O)NC2=CC=C(C)C(F)=C2)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C1=CCCCC1.CCO.COC1=CC=C([N+](=O)[O-])C(N2C(C)CCC2C)=N1.[Pd] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " COC1=CC=C(N)C(N2C(C)CCC2C)=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CCOC(=O)C1=CC(OCC2=CC=C(OC)C=C2)=C2C=C(C(F)(F)F)C=CC2=N1.N as the reactants and reagents.",
"input": "",
"output": " COC1=CC=C(COC2=CC(C(N)=O)=NC3=CC=C(C(F)(F)F)C=C23)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1=CC=C(P(C2=CC=CC=C2)[C-]2C=CC=C2)C=C1.C1COCCO1.CC1(C)OB(C2=CC(=O)CCC2)OC1(C)C.CCOC(C)=O.ClCCl.Cl[Pd]Cl.O=C([O-])[O-].O=[N+]([O-])C1=CN=CC=C1Cl.[Fe+2].[Na+] as the reactants and reagents.",
"input": "",
"output": " O=C1C=C(C2=CC=NC=C2[N+](=O)[O-])CCC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CCN(CC)CC.ClCCl.NC1=CC(Cl)=C(N)C(Cl)=C1.O=C(Cl)C(Cl)(Cl)Cl ",
"input": "",
"output": " NC1=C(Cl)C=C(NC(=O)C(Cl)(Cl)Cl)C=C1Cl ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CC1=CC=CC=C1.COC(OC)C(=O)/C=C/N(C)C.NCC1=CC=CC=C1 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: COC(OC)C(=O)/C=C/NCC1=CC=CC=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC1=CC=CC=C1.CCO.COC1=CC2=NC=CC(OC3=CC=C(N)C(C)=C3)=C2C=C1OC.O=C(N=C=S)C1=CC=CC(Cl)=C1 Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be COC1=CC2=NC=CC(OC3=CC=C(NC(=S)NC(=O)C4=CC=CC(Cl)=C4)C(C)=C3)=C2C=C1OC .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC(C)(C)CBr.CC1=CC=C(S(=O)[O-])C=C1.CCCC[N+](CCCC)(CCCC)CCCC.CN(C)C=O.O.[I-].[Na+] , what product could potentially be produced?",
"input": "",
"output": "The product can be CC1=CC=C(S(=O)(=O)CC(C)(C)C)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. NC1=CC(=O)NC(N)N1.O=P(Cl)(Cl)Cl ",
"input": "",
"output": " NC1=CC(Cl)=NC(N)=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CCCC(=O)O.CCN(C(C)C)C(C)C.CCN=C=NCCCN(C)C.CN(C)C1=CC=CC=N1.ClCCl.NC1=CC(=O)CCC1 ",
"input": "",
"output": " CCCC(=O)NC1=CC(=O)CCC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C=CC=O.CCO.COC1=CC2=C(C=C1N)O[C@H](COS(=O)(=O)C1=CC=C(C)C=C1)CO2.Cl.O=C1C(Cl)=C(Cl)C(=O)C2=CC=CC=C12.[Na+].[OH-] as the reactants and reagents.",
"input": "",
"output": " COC1=CC2=C(OC(COS(=O)(=O)C3=CC=C(C)C=C3)CO2)C2=CC=CN=C12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CC2=C(C=N1)NCCO2.CCN(CC)CC.COC1=C(Br)C=C(C(=O)Cl)C=C1Br.Cl.ClCCl Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " COC1=C(Br)C=C(C(=O)N2CCOC3=CC=NC=C32)C=C1Br ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CCOC(=O)C(C)(C)O.O=C(O)C1=CC([N+](=O)[O-])=CC=C1Cl ",
"input": "",
"output": " CCOC(=O)C(C)(C)OC(=O)C1=CC([N+](=O)[O-])=CC=C1Cl ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC1=CN=C(C(=O)CN2C=CC=C2)C=N1.ClCCl.O=C(Cl)C(Cl)(Cl)Cl.O=C([O-])O.[Na+] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CC1=CN=C(C(=O)CN2C=CC=C2C(=O)C(Cl)(Cl)Cl)C=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CC(N)C1=CC=CC2=CC=CC=C12.CCCCCCCCCCCCNC(=O)C1=CC=C(CCl)C=C1.CCCC[N+](CCCC)(CCCC)CCCC.CCN(C(C)C)C(C)C.CN1CCCC1=O.[I-] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CCCCCCCCCCCCNC(=O)C1=CC=C(CNC(C)C2=CC=CC3=CC=CC=C23)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1=CC=C(P(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.CC1(C)OB(C2=CNN=C2)OC1(C)C.FC1=CC(C2(C3=CC=C(Br)C=C3)CCNCC2)=CC=C1Cl.[Pd] ",
"input": "",
"output": " FC1=CC(C2(C3=CC=C(C4=CNN=C4)C=C3)CCNCC2)=CC=C1Cl ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CCC1=C(C(=O)OCC2=CC=CC=C2)C(C2=CC=C(F)C=C2F)NC(OC)=N1.CN(C)C1=CC=NC=C1.ClCCl.O=C(Cl)OC1=CC=C([N+](=O)[O-])C=C1 as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CCC1=C(C(=O)OCC2=CC=CC=C2)C(C2=CC=C(F)C=C2F)N(C(=O)OC2=CC=C([N+](=O)[O-])C=C2)C(OC)=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C=CC1=CN(C)C=N1.CCN(CC)CC.CN(C)C=O.Cl[Pd](Cl)([PH](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1)[PH](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1.OC1=CC=C(C2=C(OC3=CC=C(Br)C=C3)C3=CC=C(O)C=C3S2)C=C1 as the reactants and reagents.",
"input": "",
"output": " CN1C=NC(/C=C/C2=CC=C(OC3=C(C4=CC=C(O)C=C4)SC4=CC(O)=CC=C34)C=C2)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using COC(=O)C1(N)CC1.ClCCl.O.O=C(Cl)OCC1=CC=CC=C1.O=C([O-])O.[Na+] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " COC(=O)C1(NC(=O)OCC2=CC=CC=C2)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CN(C)CCCN.ClP(Cl)(Cl)(Cl)Cl.O=C(C1=CC=CC=C1)C1=C(O)C2=CC=CC=C2S1 ",
"input": "",
"output": " CN(C)CCCN/C(=C1/SC2=CC=CC=C2C1=O)C1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CCOP(=O)(CC#N)OCC.COC(=O)C=C(C1=CC=C(OC)C(OC)=C1)C1=CC=C(OC)C(OC)=C1.COC1=CC=C(C(=O)C2=CC=C([N+](=O)[O-])C=C2)C=C1OC.C[Si](C)(C)[N-][Si](C)(C)C.[Li+] ",
"input": "",
"output": " COC1=CC=C(C(=CC#N)C2=CC=C([N+](=O)[O-])C=C2)C=C1OC ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC1=CC(NS(=O)(=O)C2=CC=CC=C2N)=CN=C1C.ClCCCl.O=C(N1C=CN=C1)N1C=CN=C1 Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CC1=CC(N2C(=O)NC3=CC=CC=C3S2(=O)=O)=CN=C1C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC(C)CC1=CC(C=O)=NN1C1=CC=CC=C1.NCCN1CCN(C(C2=CC=CC=C2)C2=CC=C(Cl)C=C2)CC1 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC(C)CC1=CC(CNCCN2CCN(C(C3=CC=CC=C3)C3=CC=C(Cl)C=C3)CC2)=NN1C1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CO.C[O-].O=C(C1=NC(Cl)=C(C2=CC=CC(C(F)(F)F)=C2)C=C1Cl)N1CCC(N2CCCC2)CC1.[Na+] ",
"input": "",
"output": " COC1=NC(C(=O)N2CCC(N3CCCC3)CC2)=C(Cl)C=C1C1=CC=CC(C(F)(F)F)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CC1=C(I)C(=O)NC(=O)N1.CCOC(C)=O.CI.CN(C)C=O.O.O=C([O-])[O-].[K+] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CC1=C(I)C(=O)N(C)C(=O)N1C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CCOCC.NC1=CC=C2NC(=O)NC2=C1.O=C(CCl)N1CCC(CC2=CC=CC=C2)CC1 , what product could potentially be produced?",
"input": "",
"output": "The product can be O=C(CNC1=CC=C2NC(=O)NC2=C1)N1CCC(CC2=CC=CC=C2)CC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CCN=C=NCCCN(C)C.CN.CN(C)C=O.CN1CCOCC1.Cl.NC1=NC=C(/C=C/C(=O)O)C2=C1C(C1=CC=CC=C1)=CS2.O.ON1N=NC2=CC=CC=C21 , what product could potentially be produced?",
"input": "",
"output": "The product can be CNC(=O)/C=C/C1=CN=C(N)C2=C1SC=C2C1=CC=CC=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC(=O)NC1=NC(Cl)=C(NC=O)C(Cl)=N1.CC(=O)NC1=NC(Cl)=C(NC=O)C(N[C@@H]2C=C[C@H](CO)C2)=N1.CCN(CC)CC.CCO.CO ",
"input": "",
"output": " CC(=O)NC1=N[C@@H](Cl)C(NC=O)(N[C@H]2C=C[C@@H](CO)C2)C=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C1=CC=NC=C1.CC1(C)CC(=O)C2=CC=C(F)C=C2O1.CO.CON.Cl.[Pd] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CC1(C)CC(N)C2=CC=C(F)C=C2O1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCC1=C(C2=CC=C(O)C=C2)OC2=CC=CC=C2S1.OCCCN1CCCC1 Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CCC1=C(C2=CC=C(OCCCN3CCCC3)C=C2)OC2=CC=CC=C2S1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C1=CC=C([PH](C2=CC=CC=C2)(C2=CC=CC=C2)[Pd]([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)[PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.CC1(CO[Si](C)(C)C(C)(C)C)CC2=NN=C(C3(C4=CC=C(B5OC(C)(C)C(C)(C)O5)C=C4)CC3)N2CCS1.COCCOC.ClC1=NC=CC=N1.O.O=C([O-])O.O=C([O-])[O-].[K+].[Na+] .",
"input": "",
"output": " CC1(CO[Si](C)(C)C(C)(C)C)CC2=NN=C(C3(C4=CC=C(C5=NC=CC=N5)C=C4)CC3)N2CCS1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.C=CP(=O)(C=C)C1=CC=C([N+](=O)[O-])C=C1.CCN.Cl.O.O=C([O-])O.[Na+].[OH-] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CCN1CCP(=O)(C2=CC=C([N+](=O)[O-])C=C2)CC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1CCOC1.C=CBr.CCC(=O)CCC=C(C)CC(C)C.O=S(=O)(O)O.[MgH2] ",
"input": "",
"output": " C=CC(O)(CC)CCC=C(C)CC(C)C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CN(C)C=O.O=C1C2=CC=C(F)C=C2OC2=CC(N3CCOCC3)=CC(O)=C12.OCCO.[H-].[Na+] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " O=C1C2=CC=C(OCCO)C=C2OC2=CC(N3CCOCC3)=CC(O)=C12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(=O)O.CC(C)(C)OC(=O)NCCN.CO.O=C1CCN(C2=CC=CC=C2[N+](=O)[O-])CC1.[BH3-]C#N.[Na+] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CC(C)(C)OC(=O)NCCNC1CCN(C2=CC=CC=C2[N+](=O)[O-])CC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC1=NN(C)C=C1N1C(=O)N(C)C2=CN=C3C=CC(Br)=CC3=C21.OB(O)C1=CC=C(N2C=CC=N2)C=C1 .",
"input": "",
"output": " CC1=NN(C)C=C1N1C(=O)N(C)C2=CN=C3C=CC(C4=CC=C(N5C=CC=N5)C=C4)=CC3=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CN.O=CC1=CC=C(C2NC3=CC=CC4=C3C(=NNC4=O)C2C2=CC=CC=C2)C=C1.[BH4-].[Na+] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CNCC1=CC=C(C2NC3=CC=CC4=C3C(=NNC4=O)C2C2=CC=CC=C2)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CO.COC(=O)C1=CC=C(C)C=C1C1CCC1.O=C1CCC(=O)N1I.O=S(=O)(O)O ",
"input": "",
"output": " COC(=O)C1=CC(I)=C(C)C=C1C1CCC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C1=CC=NC=C1.C1CCOC1.CCC(=O)Cl.Cl.NC1=NC(CN2CCN(C(C3=CC=CC=C3)C3=CC=CC=C3)CC2)=CS1 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CCC(=O)NC1=NC(CN2CCN(C(C3=CC=CC=C3)C3=CC=CC=C3)CC2)=CS1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with Br.BrBr.CC1=CC(C)=NC(N)=C1.O=N[O-].[Na+].[OH-] as the reactants and reagents.",
"input": "",
"output": " CC1=CC(C)=NC(Br)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C1=CC=C(P(C2=CC=CC=C2)C2=CC=C3C=CC=CC3=C2C2=C3C=CC=CC3=CC=C2P(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.CC(=O)[O-].CC1=CC=CC=C1.ClC1=NC=CC=C1C1=CC=NC=N1.NC1=CC=C(F)C([N+](=O)[O-])=C1.O.O=C([O-])[O-].[K+].[Pd+2] .",
"input": "",
"output": " O=[N+]([O-])C1=CC(NC2=NC=CC=C2C2=CC=NC=N2)=CC=C1F ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1=CC=NC=C1.CC(=O)Cl.CC1(C)C[C@H]2[C@H]3CC4=CC=C(O)C=C4[C@@]2(CCN3CC2CC2)CO1.Cl.ClCCl ",
"input": "",
"output": " CC(=O)OC1=CC=C2C[C@@H]3[C@@H]4CC(C)(C)OC[C@]4(CCN3CC3CC3)C2=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CCN(C(C)C)C(C)C.CO.COC1=CC2=C(OC3=CC=C4NC(C)=CC4=C3)N=CN=C2C=C1OCCN1CCNCC1.ClCCl.O=C(Cl)CCl as the reactants and reagents.",
"input": "",
"output": " COC1=CC2=C(OC3=CC=C4NC(C)=CC4=C3)N=CN=C2C=C1OCCN1CCN(C(=O)CCl)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CC=C([PH+](C2=CC=CC=C2)C2CCCC2)C=C1.C1COCCO1.CC(=O)[O-].CC1(C)OB(B2OC(C)(C)C(C)(C)O2)OC1(C)C.CS(C)=O.ClCCl.Cl[Pd]Cl.FC1=CC=C(Br)C=C1C1=CC=NC=C1.[Fe].[K+] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " OB(O)C1=CC=C(F)C(C2=CC=NC=C2)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C1=CC=NC=C1.CS(=O)(=O)NC1=CC(N)=CC=C1OC1=CC=CC=C1.ClCCl.O.O=C(Cl)CCl as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CS(=O)(=O)NC1=CC(NC(=O)CCl)=CC=C1OC1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC#N.NC1=CC=CC=N1.S=C(N1C=CN=C1)N1C=CN=C1 ",
"input": "",
"output": " S=C(NC1=CC=CC=N1)N1C=CN=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCCCCC(O)CC(=O)OC(C)(C)C.CCCCCCCCCCCCCCCC(=O)O Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CCCCCCCCCCCCCCCC(=O)OC(CCCCC)CC(=O)OC(C)(C)C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CCOC(=O)C1=C(COCC2=CC=C(OC)C=C2)NC(C2=CC=C(OC(F)F)C(OCC3CC3)=C2)=C1.ClCCl.N#CC1=C(C#N)C(=O)C(Cl)=C(Cl)C1=O.O ",
"input": "",
"output": " CCOC(=O)C1=C(C=O)NC(C2=CC=C(OC(F)F)C(OCC3CC3)=C2)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C=CC(O)CCCCCC.O=CC1=CC=C(O)C=C1 as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " C=CC(CCCCC)OC1=CC=C(C=O)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CN(C)C(=O)OC(C1=CC=CC=C1)C1=NC(C2=CC=CC=C2)=C(C2=NC3=C(N)N=CN=C3S2)N1C.CN1C=CN=C1C=O as the reactants and reagents.",
"input": "",
"output": " CN(C)C(=O)OC(C1=NC=CN1C)C1=NC(C2=CC=CC=C2)=C(C2=NC3=C(N)N=CN=C3S2)N1C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CC=C(P(C2=CC=CC=C2)C2=CC=C3C=CC=CC3=C2C2=C3C=CC=CC3=CC=C2P(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.C1CNCCN1.CC1=CC=CC=C1.CCN(CC)C(=O)C1=CC=CC=C1Br.O=C(/C=C/C1=CC=CC=C1)/C=C/C1=CC=CC=C1.O=C([O-])[O-].[Cs+].[Pd] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CCN(CC)C(=O)C1=CC=CC=C1N1CCNCC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with COCCOCCOC1=CC=CC2=C1C(=O)N(CC1=CC=C(OC)C=C1)C2=O.[Al+3].[H-].[Li+] as the reactants and reagents.",
"input": "",
"output": " COCCOCCOC1=CC=CC2=C1CN(CC1=CC=C(OC)C=C1)C2 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C1CCOC1.C=CCOCC(=O)N(C)OC.CCCCCC.FC1=CC=C(Br)C=C1I.[Li]CCCC .",
"input": "",
"output": " C=CCOCC(=O)C1=CC(Br)=CC=C1F ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.CC(C)(C)[Mg]Cl.CC1=CC=C(S(=O)(=O)O)C=C1.COC1=CC2=C(C=C1Br)C(=O)CC(C)(C)O2 Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " COC1=CC2=C(C=C1Br)C(C(C)(C)C)=CC(C)(C)O2 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CCOC(=O)C(N=C(C1=CC=CC=C1)C1=CC=CC=C1)C1=NC=C(C(F)(F)F)C=C1Cl.O=C(C1=CC=CC=C1)C1=CC=CC=C1 ",
"input": "",
"output": " CCOC(=O)C(N)C1=NC=C(C(F)(F)F)C=C1Cl ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC(=O)N(C)C.CC(C)(C)OC(=O)NCCCN.CCOC(C)=O.CN1CCOCC1.O=C1COCC(=O)O1 , what product could potentially be produced?",
"input": "",
"output": "The product can be CC(C)(C)OC(=O)NCCCN1C(=O)COCC1=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C[Si](C)(C)CCOC(=O)C1=CC=CC(C=O)=C1.NC1=CC=CN=C1 .",
"input": "",
"output": " C[Si](C)(C)CCOC(=O)C1=CC=CC(CNC2=CC=CN=C2)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " COC1=CC=C(C(=O)Cl)C=C1.COC1=CC=C(N)C(OC)=C1 Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be OC1=CC=C(C2=NC3=CC=C(O)C=C3O2)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC(=CBr)C1=CC=C(Cl)C(Cl)=C1.CC1=CC=C2NC3=C(CCN(C)C3)C2=C1.CN(C)C=O.O=C(O)[C@@H]1CCCN1.O=P([O-])([O-])[O-].[Cu]I.[K+] ",
"input": "",
"output": " CC(=CN1C2=C(CCN(C)C2)C2=CC(C)=CC=C21)C1=CC=C(Cl)C(Cl)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC1(C)OB(C2=CC=C(N)N=C2)OC1(C)C.CC1=CC(C2=CC(C(F)(F)F)=NC(C3=CC=NC(Cl)=C3)=N2)=CC=C1Cl .",
"input": "",
"output": " CC1=CC(C2=CC(C(F)(F)F)=NC(C3=CC=NC(C4=CC=C(N)N=C4)=C3)=N2)=CC=C1Cl ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CO.COC(OC)OC.C[O-].O=C(CO)C1=CC=CC=C1.O=CC1=CC=C(F)C(F)=C1.[Na+] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be O=C(C=CC1=CC=C(F)C(F)=C1)C1=CC=CC=C1O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC1=NOC(N)=C1Br.COC1=CC=C(Br)C=C1S(=O)(=O)Cl Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be COC1=CC=C(Br)C=C1S(=O)(=O)NC1=C(Br)C(C)=NO1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C1CCCCC1.CC(=O)O.CCOC(C)=O.N#CC(NC(=O)C1CCCCC1NC(=O)OCC1=CC=CC=C1)C1CC1.[Pd] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " N#CC(NC(=O)C1CCCCC1N)C1CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC(C)(C)OC(=O)N1CC[C@@H](CC(=O)NNC(=O)NC2=CC=C(Br)C=C2F)C1.CC(C)(C)OC(=O)OC(=O)OC(C)(C)C.CCCO.CCOC(C)=O.Cl.O.O=C([O-])[O-].[K+] as the reactants and reagents.",
"input": "",
"output": " CC(C)(C)OC(=O)N1CC[C@@H](CC2=NNC(=O)N2C2=CC=C(Br)C=C2F)C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. C=CCBr.C=CCC(C)(CC1=CC=C(Cl)C=C1Cl)CN1CCCC1.CCOC(C)=O ",
"input": "",
"output": " C=CCC(C)(CC1=CC=C(Cl)C=C1Cl)C[N+]1(CC=C)CCCC1.[Br-] ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.CCOC(=O)CC(C)OC1=CC(F)=CC=C1[N+](=O)[O-].[Ni] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CCOC(=O)CC(C)OC1=CC(F)=CC=C1N ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CN(C)C=O.O=C(O)CS.O=C([O-])CS.[H-].[N-]=[N+]=NC[C@H]1O[C@@H](N2C(Br)=NC3=C(N)N=CN=C32)[C@H](O)[C@@H]1O.[Na+] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be [N-]=[N+]=NC[C@H]1O[C@@H](N2C(SCC(=O)O)=NC3=C(N)N=CN=C32)[C@H](O)[C@@H]1O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C.CCO.O.OC(CC1=CC=CC=C1)(CC1=CC=CC=C1)C1CN(CC2=CC=CC=C2)CCN1CC1=CC=CC=C1.[Pd] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " OC(CC1=CC=CC=C1)(CC1=CC=CC=C1)C1CNCCN1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CCN(CC)CC.CCN=C=NCCCN(C)C.CN1N=CC2=C1C1=CC=CC=C1OC21CCN(C(=O)C2=CC=CC=C2C(=O)O)CC1.CNC.Cl.ClCCl as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CN(C)C(=O)C1=CC=CC=C1C(=O)N1CCC2(CC1)OC1=CC=CC=C1C1=C2C=NN1C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CN1CCC(C2=CNC3=CC=C(N)N=C23)CC1.O=C(Cl)C1=C(F)C(F)=C(F)C(F)=C1F as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CN1CCC(C2=CNC3=CC=C(NC(=O)C4=C(F)C(F)=C(F)C(F)=C4F)N=C23)CC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if COC1=CC=C(CBr)C=C1OC.NC1=CC=CC(C2=CC=C(C3CCNCC3)C=C2)=N1 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " COC1=CC=C(CN2CCC(C3=CC=C(C4=CC=CC(N)=N4)C=C3)CC2)C=C1OC ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CCN(CC)CC.CCOC(C)=O.CN(C)C=O.NC(=O)CC1=CC=C([C@@H](O)CO)C=N1.O=[N+]([O-])C1=CC=C(S(=O)(=O)Cl)C=C1 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC(=O)NC1=CC=C([C@@H](O)COS(=O)(=O)C2=CC=C([N+](=O)[O-])C=C2)C=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC1=CC=CC=C1.CCN1C2=NC=CC=C2C(=O)N(C)C2=CC=CN=C21.COC1=CC=C(P2(=S)SP(=S)(C3=CC=C(OC)C=C3)S2)C=C1 as the reactants and reagents.",
"input": "",
"output": " CCN1C2=NC=CC=C2C(=S)N(C)C2=CC=CN=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC(C)=O.NC1=NC=CC=N1.O=CC1=CC=C(C(=O)CBr)C=C1 as the reactants and reagents.",
"input": "",
"output": " O=CC1=CC=C(C2=CN3C=CC=NC3=N2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC(=O)N(C)C.CC1=CC=C2C(=C1)C(=O)OC(=O)N2CC1=CC=C(F)C=C1.CCOC(=O)CC(=O)OCC.Cl.[H-].[H][H].[Na+] as the reactants and reagents.",
"input": "",
"output": " CCOC(=O)C1=C(O)C2=CC(C)=CC=C2N(CC2=CC=C(F)C=C2)C1=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CCOC(C)=O.COC(=O)CC(C)=O.CS(C)=O.I[Cu]I.NC1=NC=CC=C1I.O=C([O-])[O-].OC1=CC=C2C=CC=CC2=C1C1=C(O)C=CC2=CC=CC=C12.[Cs+] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: COC(=O)C1=C(C)NC2=NC=CC=C12 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1=CC=C(P(C2=CC=CC=C2)[C-]2C=CC=C2)C=C1.CC#N.CC(=O)OCC1=C(B2OC(C)(C)C(C)(C)O2)C=C(F)C=C1N1CCC2=C(SC3=C2CC(C)(C)C3)C1=O.CC(=O)[O-].CN(C)CCOC1=CC=C(NC2=CC(Br)=CN(C)C2=O)N=C1.Cl[Pd]Cl.O.O=P([O-])([O-])[O-].[Fe+2].[K+].[Na+] as the reactants and reagents.",
"input": "",
"output": " CC(=O)OCC1=C(C2=CN(C)C(=O)C(NC3=CC=C(OCCN(C)C)C=N3)=C2)C=C(F)C=C1N1CCC2=C(SC3=C2CC(C)(C)C3)C1=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CCO.CCOC(=O)CC(=O)CC(=O)CC1=CC=CC=C1[N+](=O)[O-] , what product could potentially be produced?",
"input": "",
"output": "The product can be CCOC(=O)CC(=O)CC1=CC=CC=C1[N+](=O)[O-] .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CC=C([PH](C2=CC=CC=C2)(C2=CC=CC=C2)[Pd]([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)[PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.C1CCOC1.CSC1=NC(NC2=CC=C(N3CCN(C(=O)OC(C)(C)C)CC3)C=C2F)=C(C(N)=O)C2=NN=CN12.ClC1=CC=CC(Cl)=C1C[Zn+].ClCCl.[Br-] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CC(C)(C)OC(=O)N1CCN(C2=CC=C(NC3=C(C(N)=O)C4=NN=CN4C(CC4=C(Cl)C=CC=C4Cl)=N3)C(F)=C2)CC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C=CC(=O)O.CC1(C)CC(=O)C=C(N)C1 ",
"input": "",
"output": " CC1(C)CC(=O)C2=C(C1)NC(=O)CC2 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CO.COC(=O)C1=CNC(SC2=CC=C(Cl)C(Cl)=C2)=C1.[Na+].[OH-] , what product could potentially be produced?",
"input": "",
"output": "The product can be O=C(O)C1=CNC(SC2=CC=C(Cl)C(Cl)=C2)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CCC1=C(OC2=CC(C)=CC(C)=C2)NC(=O)NC1=O.COC(=O)C1=C(CBr)OC=C1 as the reactants and reagents.",
"input": "",
"output": " CCC1=C(OC2=CC(C)=CC(C)=C2)N(CC2=C(C(=O)OC)C=CO2)C(=O)NC1=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C1CCOC1.CCN(CC)CC.Cl.N.NC1CCN(S(=O)(=O)CC2=CC=CC=C2Br)CC1 .",
"input": "",
"output": " NC(=O)NC1CCN(S(=O)(=O)CC2=CC=CC=C2Br)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CC(C)N1C=CC(C2=CC=CS2)=N1.CN(C)C=O.O=C([O-])[O-].O=C1CCC(=O)N1I.O=S([O-])([O-])=S.[Na+] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CC(C)N1C=C(I)C(C2=CC=CS2)=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C1COCCO1.CC1=CC=CNC1=O.CCOC(C)=O.N[C@@H]1CCCC[C@H]1N.O=P([O-])([O-])[O-].O=[N+]([O-])C1=CC=C(I)C=C1.[Cu]I.[K+] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC1=CC=CN(C2=CC=C([N+](=O)[O-])C=C2)C1=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CCCCCCCCCCOCC(O)CN1CCC2=CC=CC=C2C1.O=S(=O)(O)Cl as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CCCCCCCCCCOCC(CN1CCC2=CC=CC=C2C1)OS(=O)(=O)O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC(C)CN.COC1=C(NS(=O)(=O)C2=C(F)C=CC=C2F)C=CC=C1C1=C(C2=CC=NC(Cl)=N2)SC(N2CCOCC2)=N1 as the reactants and reagents.",
"input": "",
"output": " COC1=C(NS(=O)(=O)C2=C(F)C=CC=C2F)C=CC=C1C1=C(C2=CC=NC(NCC(C)C)=N2)SC(N2CCOCC2)=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. COC1=CC=C(CCNC2=CC(C=O)=NC(OC)=N2)C=C1.COCCOC.O.[C-]#[N+]CS(=O)(=O)C1=CC=C(C)C=C1 ",
"input": "",
"output": " COC1=CC=C(CCNC2=CC(C3=CN=CO3)=NC(OC)=N2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. N#CC1=C2NCC3(CN(CC4=CC=CC=C4)C3)CN2N=C1C1=CC=C(OC2=CC=CC=C2)C=C1.NC(=O)C1=C2NCCC(C3=CC=CC(NC(=O)CCCl)=C3)N2N=C1C1=CC=C(OC2=CC=CC=C2)C=C1 ",
"input": "",
"output": " NC(=O)C1=C2NCC3(CN(CC4=CC=CC=C4)C3)CN2N=C1C1=CC=C(OC2=CC=CC=C2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC(C)(C)[Si](OCCBr)(C1=CC=CC=C1)C1=CC=CC=C1.CN(C)C=O.O=C([O-])[O-].OC1=CC=C(C2=CN3C=C(I)C=CC3=N2)C=C1.[Cl-].[K+].[Na+] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC(C)(C)[Si](OCCOC1=CC=C(C2=CN3C=C(I)C=CC3=N2)C=C1)(C1=CC=CC=C1)C1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. C1=CC=C(P(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.C1CCOC1.CC(C)OC(=O)N=NC(=O)OC(C)C.O=C1C2=CC=CC=C2C(=O)N1O.OCCCOC1=CC=C(C(F)(F)F)C=N1 ",
"input": "",
"output": " O=C1C2=CC=CC=C2C(=O)N1OCCCOC1=CC=C(C(F)(F)F)C=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC(C)=O.CCCCC(C)C(=O)C=CC1CCC2(OCCO2)C1CCCCCCCO.CO.O=C(O)CC(O)(CC(=O)O)C(=O)O.O=C([O-])CC(O)(CC(=O)[O-])C(=O)[O-].[BH4-].[Cl-].[K+].[Na+] ",
"input": "",
"output": " CCCCC(C)C(O)C=CC1CCC2(OCCO2)C1CCCCCCCO ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1COCCO1.CC(C)(C)O.CC(C)(C)[O-].CN(C)C=O.COC1=CC(CN(CC(OC)OC)S(=O)(=O)C2=CC=C(C)C=C2)=CC=C1I.Cl.ClCCl.[K+] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be COC1=CC2=CN=CC=C2C=C1I .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=NC(C2CCNCC2)=CS1.CC(C)(C)OC(=O)N1[C@H](CC2=CC=C(C(=O)O)C=C2)CC[C@@H]1[C@H](O)C1=CC=CC=C1.CCN(C(C)C)C(C)C.CN(C)C=O.ClCCCl.ON1N=NC2=CC=CN=C21 Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CC(C)(C)OC(=O)N1[C@H](CC2=CC=C(C(=O)N3CCCC(C4=CSC=N4)C3)C=C2)CC[C@@H]1[C@H](O)C1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1=CC2=C(C=N1)SC=C2.CC#N.CCCCCCCCCCCCBr ",
"input": "",
"output": " CCCCCCCCCCCC[N+]1=CC=C2C=CSC2=C1.[Br-] ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using O=CC1=CC=C(N2C=CC=N2)C(F)=C1.O=CC1=CC=C(N2C=CC=N2)C=C1 as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " O=CC=CC1=CC=C(N2C=CC=N2)C(F)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. O=CC1=CC=C(N2C=CC=N2)C(F)=C1.O=CC1=CC=C(N2C=CC=N2)C=C1 ",
"input": "",
"output": " O=C/C=C/C1=CC=C(N2C=CC=N2)C(F)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC(C)(C)OC(=O)NC[C@H]1CC[C@H](NC2=C([N+](=O)[O-])C=NC3=C2SC=C3)CC1.CO.[H][H].[Pd] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CC(C)(C)OC(=O)NC[C@H]1CC[C@H](NC2=C(N)C=NC3=C2SC=C3)CC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC1=CC2=CC(Br)=CN=C2N1.ClCCl.O=C(Cl)CCl.[Al+3].[Cl-] as the reactants and reagents.",
"input": "",
"output": " CC1=C(C(=O)CCl)C2=CC(Br)=CN=C2N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1COCCO1.CCN1C(=O)C(C2=CC(NC(=O)NC3=CC=C(F)C(CN4CCOCC4)=C3)=C(F)C=C2Cl)=CC2=CN=C(Cl)C=C21.CCOC(C)=O.CN(C)C=O.COC1=CC=C(OC)C(P(C2CCCCC2)C2CCCCC2)=C1C1=C(C(C)C)C=C(C(C)C)C=C1C(C)C.Cl[Pd+].NC=O.NCCC1=[C-]C=CC=C1.O=C([O-])[O-].[K+] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CCN1C(=O)C(C2=CC(NC(=O)NC3=CC=C(F)C(CN4CCOCC4)=C3)=C(F)C=C2Cl)=CC2=CN=C(NC=O)C=C21 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) BrB(Br)Br.COC(=O)CCCCC1=NC(C2=CC=CC=C2OC)=C(C)O1.ClCCl as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: COC(=O)CCCCC1=NC(C2=CC=CC=C2O)=C(C)O1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CN(C)C=O.FC(F)(F)I.O.O=C([O-])[O-].S=C1NC2=CC(Cl)=C(OC3=CC=CC(Cl)=C3Cl)C=C2N1.[K+] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " FC(F)(F)SC1=NC2=CC(Cl)=C(OC3=CC=CC(Cl)=C3Cl)C=C2N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CCC1=CC=C(CC2=CC3=C(C=C2Cl)CO[C@]32O[C@H](COS(=O)(=O)C3=CC=C(C)C=C3)[C@@H](O)[C@H](O)[C@H]2O)C=C1.[Na+].[O-]CC(F)(F)F is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CCC1=CC=C(CC2=CC3=C(C=C2Cl)CO[C@]32O[C@H](COCC(F)(F)F)[C@@H](O)[C@H](O)[C@H]2O)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CCCC1=CC(OC)=CC=N1.COC1=CC=C(C(=O)CBr)C=C1 ",
"input": "",
"output": " CCC1=C2C=C(OC)C=CN2C=C1C1=CC=C(OC)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C1=CC=NC=C1.CC(C)CN.CN(C)C=O.O=C(CCl)NC1=CC=CC2=C1C(=O)C1=C(NC(=O)CCl)C=CC=C1C2=O , what product could potentially be produced?",
"input": "",
"output": "The product can be CC(C)CNCC(=O)NC1=CC=CC2=C1C(=O)C1=C(NC(=O)CNCC(C)C)C=CC=C1C2=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CCCCC1=C(OC)C(OCOC)=C(CCCCCC2=C(OC)C(OCOC)=CC(OC)=C2OCOC)C(OC)=C1OCOC.CCOC(=O)Cl is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CCCCC1=C(OC)C(OCOC)=C(CCCCCC2=C(OCOC)C(OC)=C(C(=O)OCC)C(OCOC)=C2OC)C(OC)=C1OCOC ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CN1C=C(C2=NNC(=O)N2C2=CN(CCCN)C3=CC=C(F)C=C23)C2=CC=C(OCC3=CC=CC=C3)C=C21.CO.O=C(O)C(F)(F)F.[Pd] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CN1C=C(C2=NNC(=O)N2C2=CN(CCCN)C3=CC=C(F)C=C23)C2=CC=C(O)C=C21 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses BrC1=CN=C2N=NN(CC3=CC=C4N=CC=CC4=C3)C2=N1.C1COCCO1.CC1(C)C2=CC=CC(P(C3=CC=CC=C3)C3=CC=CC=C3)=C2OC2=C(P(C3=CC=CC=C3)C3=CC=CC=C3)C=CC=C21.CN1C=CC(N)=N1.N#N.NCC1=CC=C2N=CC=CC2=C1.O.O=C(/C=C/C1=CC=CC=C1)/C=C/C1=CC=CC=C1.O=C([O-])[O-].[Cs+].[Pd] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CN1C=CC(NC2=CN=C3N=NN(CC4=CC=C5N=CC=CC5=C4)C3=N2)=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC1=CC=NC=N1.CO.O=C1OC(=O)C2=CC=CC=C12 Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " O=C1C2=CC=CC=C2C(=O)C1C1=CC=NC=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CCO.CN(C)C=NS(=O)(=O)C1=CC(CN2CCC(OC3=CC=C4C=NC=CC4=C3)CC2)=CC=C1Cl.Cl.[Na+].[OH-] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: NS(=O)(=O)C1=CC(CN2CCC(OC3=CC=C4C=NC=CC4=C3)CC2)=CC=C1Cl .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC(C)CBr.CC1(C)CNC(=NC2=CC=CC(Cl)=C2Cl)S1 ",
"input": "",
"output": " CC(C)CN1CC(C)(C)SC1=NC1=CC=CC(Cl)=C1Cl ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. NCC(C1=CC=C(F)C=C1)C1=CC=C(C(F)(F)F)N=C1.O=C(O)C1=CC=CC=C1Cl ",
"input": "",
"output": " O=C(NCC(C1=CC=C(F)C=C1)C1=CC=C(C(F)(F)F)N=C1)C1=CC=CC=C1Cl ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC1(C)OC(=O)C2=CC(N(CC3=CC=C(C#CC4=CC=C(Cl)C=C4)C=C3)C(=O)CCC3CCCC3)=CC=C2O1.[Na+].[OH-] as the reactants and reagents.",
"input": "",
"output": " O=C(O)C1=CC(N(CC2=CC=C(C#CC3=CC=C(Cl)C=C3)C=C2)C(=O)CCC2CCCC2)=CC=C1O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCCCCC.CCOCC.CN(C)C=C1C(=O)NC2=CC=CC=C12.CN(C)C=O.COC1=CC=CC(I)=C1.[H-].[Na+] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " COC1=CC=CC(N2C(=O)C(=CN(C)C)C3=CC=CC=C32)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC1=CC=C(N=C(O)C2=C(C(O)=S)C=C([N+](=O)[O-])C=C2C2=CC=CC=C2)C=C1.CO.CS(C)=O.C[O-].Cl.[Na+] .",
"input": "",
"output": " COC1=CC(C(O)=S)=C(C(O)=NC2=CC=C(C)C=C2)C(C2=CC=CC=C2)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C[Si](C)(C)CCOCN1C(O[C@@H]2CO[C@H]3[C@@H]2OC[C@H]3O)=NC2=CC(Cl)=C(C3=CC=C(Br)C=C3)N=C21.O=C(NC1CCNCC1)OC1CCOCC1 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " C[Si](C)(C)CCOCN1C(O[C@@H]2CO[C@H]3[C@@H]2OC[C@H]3O)=NC2=CC(Cl)=C(C3=CC=C(N4CCC(NC(=O)OC5CCOCC5)CC4)C=C3)N=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)N=C=NC(C)C.CN(C)C=O.CNC1=CC(OCC(F)F)=C(C(=O)NC2=CC=C(Br)C=C2)C=C1N.O=C(NCC1=CC=C(C(F)(F)F)C(N=C=S)=C1)C1(C(F)(F)F)CC1 Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CN1C(NC2=CC(CNC(=O)C3(C(F)(F)F)CC3)=CC=C2C(F)(F)F)=NC2=CC(C(=O)NC3=CC=C(Br)C=C3)=C(OCC(F)F)C=C21 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CO.COC(=O)C1CCN(C2=CC=C([N+](=O)[O-])C3=C2CN(C)C3=O)CC1.[H][H].[Pd] .",
"input": "",
"output": " COC(=O)C1CCN(C2=CC=C(N)C3=C2CN(C)C3=O)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. COC(=O)/C=C/C1=CC=C(OC)C(OC2CCCC2)=C1.COCN(CC1=CC=CC=C1)C[Si](C)(C)C.ClCCl.O=C(O)C(F)(F)F ",
"input": "",
"output": " COC(=O)[C@@H]1CN(CC2=CC=CC=C2)C[C@H]1C1=CC=C(OC)C(OC2CCCC2)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C[O+](C)C.ClCCl.F[B-](F)(F)F.O=C1CCC=CCCN1 Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be COC1=NCCC=CCC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(=O)C1=CNC2=CC=C(Cl)C=C12.CCO.CCOC(=O)C(=O)OCC.[NaH] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CCOC(=O)C(O)=CC(=O)C1=CNC2=CC=C(Cl)C=C12 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1COCCN1.CC(=O)[O-].CC(C)(C)P(C1=CC=CC=C1C1=CC=CC=C1)C(C)(C)C.CC(C)(C)[O-].CC1=CC=CC=C1.CCOC(C)=O.O=C(C1=CC=C(I)C=N1)N1CCCCC1.[Na+].[Pd+2] ",
"input": "",
"output": " O=C(C1=CC=C(N2CCOCC2)C=N1)N1CCCCC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CN.CN(C)C=O.CS(=O)(=O)C1=CC=C(F)C([N+](=O)[O-])=C1 .",
"input": "",
"output": " CS(=O)(=O)C1=CC=C(CN)C([N+](=O)[O-])=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC(=O)OC(C)=O.CCN(CC)CC.CN1N=CC(N)=C1N.O.O=CO.O=S(=O)(O)O.[Cl-].[Na+] .",
"input": "",
"output": " CN1N=CC(NC=O)=C1N ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1=CC=C(P(C2CCCCC2)C2CCCCC2)C(C2=CC=CC=C2P(C2CCCCC2)C2CCCCC2)=C1.CN(C1=NC=CC=C1CNC1=CC=CN2N=C(Cl)N=C12)S(C)(=O)=O.CN1CCN(C2=CC=C(N)C=C2)CC1 as the reactants and reagents.",
"input": "",
"output": " CN1CCN(C2=CC=C(NC3=NN4C=CC=C(NCC5=CC=CN=C5N(C)S(C)(=O)=O)C4=N3)C=C2)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C1COCCO1.CC1=CNN=C1.COC(=O)C1=CC(S(C)(=O)=O)=CC=C1I.ClCCl.N[C@@H]1CCCC[C@H]1N.O.O=C([O-])[O-].[Cu]I.[K+] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " COC(=O)C1=CC(S(C)(=O)=O)=CC=C1N1C=C(C)C=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C1=CC=C(P(C2=CC=CC=C2)C2=CC=C3C=CC=CC3=C2C2=C3C=CC=CC3=CC=C2P(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.CC(C)(C)[O-].CC1=CC=CC=C1.CCOC(=O)C1=CN(CC)C2=CC=C(I)C=C2C1=O.N=C(C1=CC=CC=C1)C1=CC=CC=C1.O=C(/C=C/C1=CC=CC=C1)/C=C/C1=CC=CC=C1.[Na+].[Pd] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CCOC(=O)C1=CN(CC)C2=CC=C(N=C(C3=CC=CC=C3)C3=CC=CC=C3)C=C2C1=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC#N.CO.COC(=O)C1=CC(=O)C2=CC([N+](=O)[O-])=CC=C2N1.O=C=NS(=O)(=O)Cl Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " COC(=O)C1=CC(N)=C2C=C([N+](=O)[O-])C=CC2=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C1CCOC1.CCOC(=O)C(C)=P(C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1.C[C@@]1(C=O)S[C@@H]2CC(=O)N2[C@H]1C(=O)OC(C1=CC=CC=C1)C1=CC=CC=C1 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CCOC(=O)/C(C)=C/[C@]1(C)S[C@@H]2CC(=O)N2[C@H]1C(=O)OC(C1=CC=CC=C1)C1=CC=CC=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. COC1(CN(C(=O)OC(C)(C)C)C2=CC=CC(C3=CC(F)=NC=C3Cl)=N2)CCOCC1.ClCCl.O=C(O)C(F)(F)F ",
"input": "",
"output": " COC1(CNC2=CC=CC(C3=CC(F)=NC=C3Cl)=N2)CCOCC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC1=CC=C(S(=O)(=O)O)C=C1.CC1=CC=CC=C1.CCOC(=O)C1=NC=C2NC3=CC=C(C4COC(O)C4)C=C3C2=C1C.CCOC(OCC)OCC Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CCOC(=O)C1=NC=C2NC3=CC=C(C4COC(OCC)C4)C=C3C2=C1C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with COCC(C)NC(=O)C1=CC(N)=CC(C2=CC=C(C)C=C2)=C1.O.O=C(O)C(F)(F)F.O=N[O-].[N-]=[N+]=[N-].[Na+] as the reactants and reagents.",
"input": "",
"output": " COCC(C)NC(=O)C1=CC(N=[N+]=[N-])=CC(C2=CC=C(C)C=C2)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC#CCOC1=NC=NC(Cl)=C1F.CN(C)C=O.O=C([O-])[O-].OC1=CC=CC=C1.[Cl-].[K+].[NH4+] ",
"input": "",
"output": " CC#CCOC1=NC=NC(OC2=CC=CC=C2)=C1F ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C1CCNCC1.CC(=O)O[BH-](OC(C)=O)OC(C)=O.ClCCl.O=CC1=CC2=CC=C(OC3=NC4=NC=CC=C4S3)C=C2N1.[Na+] .",
"input": "",
"output": " C1=CN=C2N=C(OC3=CC=C4C=C(CN5CCCCC5)NC4=C3)SC2=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC(C)O.CCOC(=O)C1=C(C2=CC=C(O)C=C2)C(=O)C2=C(O)C=C(O)C=C2O1.Cl as the reactants and reagents.",
"input": "",
"output": " CC(C)OC(=O)C1=C(C2=CC=C(O)C=C2)C(=O)C2=C(O)C=C(O)C=C2O1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CNC.CO.COC1=CC=C(N(C)C2=NC(Cl)=NC3=CC=CC=C23)C=N1 ",
"input": "",
"output": " COC1=CC=C(N(C)C2=NC(N(C)C)=NC3=CC=CC=C23)C=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC(C)CCC[C@@H](C)C1=CC[C@H]2[C@@H]3CC=C4C(C)(C)C(=O)CC[C@]4(C)[C@H]3CC[C@]12C.CCOCC.O.[Al+3].[H-].[Li+] as the reactants and reagents.",
"input": "",
"output": " CC(C)CCC[C@@H](C)C1=CC[C@H]2[C@@H]3CC=C4C(C)(C)[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C1COCCO1.CCOCC.CN1C=C(B2OC(C)(C)C(C)(C)O2)C=N1.N#N.NC(=O)C1=C(N[C@@H]2CN(C(=O)OCC3=CC=CC=C3)CC23CCC3)C2=CC(Br)=CN2N=C1.O=P([O-])([O-])[O-].[K+] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CN1C=C(C2=CN3N=CC(C(N)=O)=C(N[C@@H]4CN(C(=O)OCC5=CC=CC=C5)CC45CCC5)C3=C2)C=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C=CCC(C1=C(OC)C=C(F)C=C1OC)N(CC1=CC=CC(C2=CC=CC=C2)=C1)C(=O)C=C.CC(C)[O-].ClCCl.Cl[Ru](Cl)=CC1=CC=CC=C1.[Ti+4] ",
"input": "",
"output": " COC1=CC(F)=CC(OC)=C1C1CC=CC(=O)N1CC1=CC=CC(C2=CC=CC=C2)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCN(C(C)C)C(C)C.COC1=CC(CNC[C@@H](O)[C@H](CC2CCCCC2)NC(=O)OC(C)(C)C)=CC(OC)=C1.ClCCl.O=C(Cl)OCC1C2=CC=CC=C2C2=CC=CC=C21 Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " COC1=CC(CN(C[C@@H](O)[C@H](CC2CCCCC2)NC(=O)OC(C)(C)C)C(=O)OCC2C3=CC=CC=C3C3=CC=CC=C32)=CC(OC)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCO.CCOC(=O)CON=C(C(=O)NC1C(=O)N2C(C(=O)O)=C(CSC3=NN=NN3CCNC(=O)OC(C)(C)C)CS[C@H]12)C1=CSC(NC=O)=N1.Cl Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CCOC(=O)CON=C(C(=O)NC1C(=O)N2C(C(=O)O)=C(CSC3=NN=NN3CCN)CS[C@H]12)C1=CSC(N)=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)N1N=C(C2=NC(S(C)(=O)=O)=C(N)N=C2C2=CC=CC=C2)C=CC1=O.CCCCCC.CCCCO.Cl.[H-].[Na+] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CCCCOC1=NC(C2=NN(C(C)C)C(=O)C=C2)=C(C2=CC=CC=C2)N=C1N ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC1=CC(C)=C(S(=O)(=O)ON)C(C)=C1.CC1=CC=C(C=O)S1.COC(=O)C1=CN=C(N)C(N)=C1 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: COC(=O)C1=CN2N=C(C3=CC=C(C)S3)N=C2C(N)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC1=CC(N(C)C)=NC=C1[N+](=O)[O-].CCO.[Pd] as the reactants and reagents.",
"input": "",
"output": " CC1=CC(N(C)C)=NC=C1N ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CCO.COC(=N)CCSCC1=CSC(NC(=N)N)=N1.O , what product could potentially be produced?",
"input": "",
"output": "The product can be N=C(N)NC1=NC(CSCCC(N)=O)=CS1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. BrBr.CN(C)C=O.COC(=O)C1=C(N)C=CC2=CC=CC=C12.ClC(Cl)Cl ",
"input": "",
"output": " COC(=O)C1=C(N)C(Br)=CC2=C1CCCC2 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCCCCC.CCCCCC1=C(C(C)C)N=C(C(C)C)C(CO)=C1C1=CC=C(F)C=C1.ClCCl Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CCCCCC1=C(C(C)C)N=C(C(C)C)C(C(C)O)=C1C1=CC=C(F)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. BrCC1=CC=CC=C1.CC(C)(C)OC(=O)N1[C@@H]2C[C@@H]2C[C@H]1C(=O)O.O.O=C([O-])[O-].[Cs+] ",
"input": "",
"output": " CC(C)(C)OC(=O)N1[C@@H]2C[C@@H]2C[C@H]1C(=O)OCC1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC1=NNC(=O)N(N)C1.CN(C)C=O.COC1=CC=CC(C2=NC=C(C(=O)O)C=N2)=C1.COC1=NC(OC)=NC([N+]2(C)CCOCC2)=N1.O.[Cl-] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " COC1=CC=CC(C2=NC=C(C(=O)NN3CC(C)=NNC3=O)C=N2)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC(=O)N(C)C1=NC=C(C#N)C=N1.CO.N.[Ni].[OH-] ",
"input": "",
"output": " CC(=O)N(C)C1=NC=C(CN)C=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CCO.COC(=O)CCC(N)=S.O=C(CBr)C1=CC=C(F)C=C1 as the reactants and reagents.",
"input": "",
"output": " CCOC(=O)CCC1=NC(C2=CC=C(F)C=C2)=CS1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1CCOC1.CC1=CC(C(=O)N2C[C@H]([C@H](CO[Si](C)(C)C(C)(C)C)OC3=CC=C(Cl)C=N3)[C@@H](C3=CC=C(F)C(F)=C3)C2)=CN=N1.CCCC[N+](CCCC)(CCCC)CCCC.CCOC(C)=O.[F-] as the reactants and reagents.",
"input": "",
"output": " CC1=NC=C(C(=O)N2C[C@H]([C@H](CO)OC3=CC=C(Cl)C=N3)[C@@H](C3=CC=C(F)C(F)=C3)C2)C=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC(=O)O.CC1(C)OCC([C@@H]2C[C@H]3OC(C)(C)O[C@H]3O2)O1.O.O=C([O-])O.[Na+] , what product could potentially be produced?",
"input": "",
"output": "The product can be CC1(C)O[C@H]2O[C@H]([C@@H](O)CO)C[C@H]2O1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses ClCl.F.O=C(Cl)C1=CC(Cl)=C(Cl)C(Cl)=C1Cl.[F-].[K+] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: O=C(F)C1=CC(Cl)=C(Cl)C(Cl)=C1Cl .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCOC(C)=O.O=C(CBr)C1=CC=CC=C1.O=C(O[C@H]1CN2CCC1CC2)C(NS(=O)(=O)CC(F)(F)F)C1=CC=CC=C1 Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be O=C(C[N+]12CCC(CC1)[C@@H](OC(=O)C(NS(=O)(=O)CC(F)(F)F)C1=CC=CC=C1)C2)C1=CC=CC=C1.[Br-] .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(=O)N(C)C.O.O=C(CBr)C1=C2C=CC(C(F)(F)F)=CN2N=C1C1=CC=CC(Br)=C1.[F-].[K+] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be O=C(CF)C1=C2C=CC(C(F)(F)F)=CN2N=C1C1=CC=CC(Br)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using BrC1=CC=C2C=CN=CC2=C1.C1CCOC1.CC(C)O.CN(C)CCN(C)C.O=C=O.[Li]CCCC as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " OC1=NC=CC2=CC=CC=C12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1COCCO1.CN1C(=O)N([C@@H]2CCN(C(=O)OC(C)(C)C)C2)C2=NC=C(Cl)C=C21.Cl.ClCCl Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CN1C(=O)N([C@@H]2CCNC2)C2=NC=C(Cl)C=C21 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) Br.CC(=O)O.COC1=CC=NC(Cl)=C1C#N as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: N#CC1=C(O)C=CN=C1Br .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1COCCO1.CCN(CC)CC.CN1CCC(=O)CC1.C[Si](C)(C)Cl ",
"input": "",
"output": " CN1CC=C(O[Si](C)(C)C)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC(=O)OC(C)=O.CCOC(=O)C(=CN(C1=CC=C(F)C(N2CCN(C(=O)OCC)CC2)=N1)C1CC1)C(=O)OCC.O=S(=O)(O)O .",
"input": "",
"output": " CCOC(=O)C1=CN(C2CC2)C2=NC(N3CCN(C(=O)OCC)CC3)=C(F)C=C2C1=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C1CCOC1.C=C(C)CC(C(=O)OC)C(=O)OC.O.[Al+3].[H-].[Li+].[Na+].[OH-] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " C=C(C)CC(CO)CO ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCO.CCOC(=O)C1=C(Cl)C=C(Br)C(=O)N1.N Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be NC(=O)C1=C(Cl)C=C(Br)C(=O)N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1CCOC1.CC(C)(C)C1=CC=C(S(=O)(=O)NC2=CC=C(Cl)C=C2C(=O)C2=CC=C(Cl)N=C2)C=C1.C[S-].[Na+] as the reactants and reagents.",
"input": "",
"output": " CSC1=CC=C(C(=O)C2=CC(Cl)=CC=C2NS(=O)(=O)C2=CC=C(C(C)(C)C)C=C2)C=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CC=CC=C1.C1CCNCC1.CC(=O)O.COC(=O)/C=C(/C)N.COC(=O)CC(=O)C(OC)OC.O=CC1=CC=CC([N+](=O)[O-])=C1 Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be COC(=O)C1=C(C)NC(C(OC)OC)=C(C(=O)OC)C1C1=CC=CC([N+](=O)[O-])=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCO.O=[N+]([O-])C1=CC=C2C3=CC=C([N+](=O)[O-])C=C3S(=O)C2=C1.[Pd] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " NC1=CC=C2C(=C1)SC1=CC(N)=CC=C12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C1=CC=C([PH](C2=CC=CC=C2)(C2=CC=CC=C2)[Pd]([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)[PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.CN1C(=O)CC2=C1C=CC(Br)=C2OCC1=CC=CC=C1.COCCOC.ClCCl.O=C([O-])[O-].OB(O)C1=CC=CN=C1.[Na+] , what product could potentially be produced?",
"input": "",
"output": "The product can be CN1C(=O)CC2=C1C=CC(C1=CC=CN=C1)=C2OCC1=CC=CC=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C1=CC=C(P(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.CCOC(=O)N=NC(=O)OCC.CSC1=NC=NC2=CC(O)=CC=C12.ClCCl.OCC#CCN1CCOCC1 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CSC1=NC=NC2=CC(OCC#CCN3CCOCC3)=CC=C12 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC1=CC=CC=C1.CCO.CCOC(=O)C(C)(C)OC1=CC=C(OCCC2=C(C)OC(C3=CC=C(Br)C=C3)=N2)C=C1.O=C([O-])[O-].OB(O)C1=CC=NC=C1.[Na+] ",
"input": "",
"output": " CCOC(=O)C(C)(C)OC1=CC=C(OCCC2=C(C)OC(C3=CC=C(C4=CC=NC=C4)C=C3)=N2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C#CC1=CC=CC(NC(=O)C2=C(C)C=CO2)=C1.CCN(C(C)C)C(C)C.CCOC(C)=O.CN(C)C=O.COC(=O)C1=CN=C(N)C(I)=C1.Cl[Pd](Cl)([PH](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1)[PH](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1.[Cu]I Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be COC(=O)C1=CN=C(N)C(C#CC2=CC=CC(NC(=O)C3=C(C)C=CO3)=C2)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: COC1=CC=C(Cl)C=C1S(=O)(=O)Cl.N#CC1=CC=C(NC(=O)C2=CC=C3CCNC3=C2)C=C1 , what product could potentially be produced?",
"input": "",
"output": "The product can be COC1=CC=C(Cl)C=C1S(=O)(=O)N1CCC2=CC=C(C(=O)NC3=CC=C(C#N)C=C3)C=C21 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC(=O)N1CCCN(C(=O)N2CCOCC2)CC1.COC1=CC(N)=C(C#N)C=C1OCC1=CC=CC=C1.ClCCl.O=P(Cl)(Cl)Cl is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " COC1=CC(N=C(C)N2CCCN(C(=O)N3CCOCC3)CC2)=C(C#N)C=C1OCC1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C#CC1=CC=CC=C1F.CC1=NN2C=C(Br)C=NC2=C1 , what product could potentially be produced?",
"input": "",
"output": "The product can be CC1=NN2C=C(C#CC3=CC=CC=C3F)C=NC2=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCO.COC(=O)[C@@H](N)CCCN.Cl.N#C[S-].O.[K+] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " NCCCC1=CNC(=S)N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C1CCOC1.C=C(C1=CC=CC(I)=C1)C1=CC2=C(C=C1C)C(C)(C)CCC2(C)C.Cl.[Na+].[OH-] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: C=C(C1=CC=CC(C=CC(=O)O)=C1)C1=CC2=C(C=C1C)C(C)(C)CCC2(C)C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C1CCOC1.CC#N.CCC[N+](CCC)(CCC)CCC.CCO.COCC1=C(C(=O)OC)OC2=CC=C(F)C=C12.C[N+]1([O-])CCOCC1.O=[Ru](=O)(=O)[O-].[BH4-].[Ca+2].[Cl-].[NH4+].[Na+] .",
"input": "",
"output": " COCC1=C(C=O)OC2=CC=C(F)C=C12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC#N.CC(C)N1N=CC=C1C1=NC=CC=C1O.O.O=C([O-])[O-].O=CC1=CC=CC=C1CBr.[K+] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CC(C)N1N=CC=C1C1=NC=CC=C1OCC1=CC=CC=C1C=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC1CC2=CC=C(B3OC(C)(C)C(C)(C)O3)C=C2CN1C1=CC(N2CCN(C)CC2)=NC(N)=N1.CCOC1=NC(Br)=CS1 Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CCOC1=NC(C2=CC=C3CC(C)N(C4=CC(N5CCN(C)CC5)=NC(N)=N4)CC3=C2)=CS1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C/C(N)=C/C(=O)NC1=CC=C(N2CCOCC2)C(C(F)(F)F)=C1.CCOC(C)(OCC)OCC .",
"input": "",
"output": " CC1=CC(=O)N(C2=CC=C(N3CCOCC3)C(C(F)(F)F)=C2)C(C)=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC(C)(C)OC(=O)CBr.CC1(C2=CC=CC=C2)NC(=O)N(C(=O)C2=CC=CC3=CC=CC=C23)C1=O.CCOC(C)=O.CN(C)C=O.O.O=C([O-])[O-].[K+] ",
"input": "",
"output": " CC(C)(C)OC(=O)CN1C(=O)N(C(=O)C2=CC=CC3=CC=CC=C23)C(=O)C1(C)C1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. C1=CC=C(P(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.C1CCOC1.CC(C)(C)OC(=O)N=NC(=O)OC(C)(C)C.O=C1C2=CC=CC=C2C2=NC=C(O)C=C12.O=C1CCCN1CCO ",
"input": "",
"output": " O=C1C2=CC=CC=C2C2=NC=C(OCCN3CCCC3=O)C=C12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC(=O)OC(C)=O.CCN(CC)CC.ClCCl.NCC1=CC=C(C2=NOC(C3=CC(Cl)=CC(Cl)=C3)(C(F)(F)F)C2)C=C1[N+](=O)[O-].O as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CC(=O)NCC1=CC=C(C2=NOC(C3=CC(Cl)=CC(Cl)=C3)(C(F)(F)F)C2)C=C1[N+](=O)[O-] .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CCCN(CCC)C(=O)C1=CC(C(=O)O)=CC(C2=CSC=C2)=C1.CCN(CC)CC.CN(C)C=O.COC1=CC=CC(CNC[C@@H](O)[C@@H](N)CC2=CC(F)=CC(F)=C2)=C1.ClCCCl.O.O=C(O)C(F)(F)F.ON1N=NC2=CC=CC=C21 , what product could potentially be produced?",
"input": "",
"output": "The product can be CCCN(CCC)C(=O)C1=CC(C(=O)N[C@@H](CC2=CC=CC=C2)[C@H](O)CNCC2=CC=CC(OC)=C2)=CC(C2=CSC=C2)=C1.Cl .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CCOC(=O)NC1=NC2=CC=C(C)C=C2N=C1OC.COC1=CC=CC=C1N1CCNCC1 as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " COC1=CC=CC=C1N1CCN(C(=O)NC2=NC3=CC=C(C)C=C3N=C2OC)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1=C[CH-]C=C1.CC(C)(C)C1=C(C(C)(C)C)[C-](P)C=C1.CCOC(C)=O.COCCOC.Cl[Pd]Cl.FC1(F)CCC(C=CC2=NC3=CC(Br)=CC=C3N2)CC1.O.O=C([O-])[O-].OB(O)C1=C(F)C=CC=C1C(F)(F)F.[Fe+2].[Na+] ",
"input": "",
"output": " FC1=CC=CC(C(F)(F)F)=C1C1=CC=C2NC(C=CC3CCC(F)(F)CC3)=NC2=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C1CCOC1.CC(C)C(=O)O[C@H](OC(=O)ON1C(=O)[C@@H](OC(=O)C2=CC=CC=C2)[C@H](OC(=O)C2=CC=CC=C2)C1=O)C(C)C.NCCCP(O)O.O as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CC(C)C(=O)O[C@H](OC(=O)NCCCP(O)O)C(C)C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC1=CC=C(S(=O)(=O)N=[N+]=[N-])C=C1.CCO.NC(=O)CC(N)=O Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be NC(=O)C1=C(O)N=NN1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CN1C=CN=C1C1=CC=CC=C1NC1=NC(Cl)=NC=C1Cl.NC(=O)[C@@H]1[C@H](NC2=NC(Cl)=NC=C2Cl)[C@H]2C=C[C@@H]1C2.NC1=CC=C2CCC(O)CCC2=C1.O=C1CCC2=CC=C([N+](=O)[O-])C=C2CC1 Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be NC(=O)[C@@H]1[C@H](NC2=NC(NC3=CC=C4CCC(O)CCC4=C3)=NC=C2Cl)[C@H]2C=C[C@@H]1C2 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1CCOC1.CN(C)C(=O)CCl.OCC1=CN=CC(Br)=C1.[H-].[Na+] ",
"input": "",
"output": " CN(C)C(=O)COCC1=CN=CC(Br)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C=CC(C)(C)CC(=O)OC.CC1=CC(COC2=CC=C(C=NO)C=C2)=C2C=CC=CC2=N1 .",
"input": "",
"output": " COC(=O)CC(C)(C)C1CC(C2=CC=C(OCC3=CC(C)=NC4=CC=CC=C34)C=C2)=NO1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC(C)O.ClC1=CC=C2C=CC=CC2=N1.NCCCN(CCO)CCO.O=C([O-])[O-].[Na+] as the reactants and reagents.",
"input": "",
"output": " OCCN(CCO)CCCNC1=CC=C2C=CC=CC2=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C.C1=CSC=C1.C1CCOC1.CC(=O)O.CC1=CC=C(C2=C(Cl)N=CN=C2Cl)C=C1.CCCCCC.N#CC1=C(C#N)C(=O)C(Cl)=C(Cl)C1=O.O.[Li]CCCC as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CC1=CC=C(C2=C(Cl)N=C(C3=CC=CS3)N=C2Cl)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CN(C)C=O.ClCCCBr.N#CC(C#N)CC1=CC=C(C(F)(F)F)C=C1.[H-].[Na+] ",
"input": "",
"output": " N#CC(C#N)(CCCCl)CC1=CC=C(C(F)(F)F)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CN(C)C=O.ClCCl.O=C(Cl)C1=CC=CC=C1.O=C(OCC1=CC=CC=C1)C1=CC=C2NC=CC2=C1.[H-].[Na+] as the reactants and reagents.",
"input": "",
"output": " O=C(OCC1=CC=CC=C1)C1=CC=C2C(=C1)C=CN2C(=O)C1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC1=CSC2=NC(C[P+](C3=CC=CC=C3)(C3=CC=CC=C3)C3=CC=CC=C3)=CC(=O)N12.COC1=CC=CC(C=O)=C1OCC1CC1.CS(C)=O.[Cl-].[H-].[Na+] , what product could potentially be produced?",
"input": "",
"output": "The product can be COC1=CC=CC(/C=C/C2=CC(=O)N3C(C)=CSC3=N2)=C1OCC1CC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC(C)C1=CC2=C(C3=CC=CC=C3)C=CC=C2C1[Si](C)(C)Cl.CC1=CC2=CC3=C(CCC3)C(C3=CC=CC=C3)=C2C1.CCCCCC.CCOCC.N#C[Cu]C#N.[Cl-].[Li]CCCC.[NH4+] ",
"input": "",
"output": " CC1=CC2=CC3=C(CCC3[Si](C)(C)C3C(C(C)C)=CC4=C(C5=CC=CC=C5)C=CC=C43)C(C3=CC=CC=C3)=C2C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C1CCOC1.CC(C)OB(OC(C)C)OC(C)C.CC(C)[N-]C(C)C.CC1=CC=CC=C1.CCOC(=O)C1=CC=C2C(=C1)C=CN2C(=O)OC(C)(C)C.Cl.O.[Li+] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CCOC(=O)C1=CC=C2NC(B(O)O)=CC2=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1COCCO1.CC1=NN(C2=CC(Cl)=CC=C2[C@@H](O)C(F)(F)F)C=C1.NC1=NC(Cl)=CC(Cl)=N1.O=C([O-])[O-].[Cs+] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CC1=NN(C2=CC(Cl)=CC=C2[C@@H](OC2=CC(Cl)=NC(N)=N2)C(F)(F)F)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C1CCCCC1.CC1=C(C2=CC=NN2C2=CC=C(C#N)C=C2)NC(=O)N1C1=CC=CC(C(F)(F)F)=C1.CCN(CC)CC.CCNC.CCOC(C)=O.ClCCl.O=C(Cl)OC1=CC=C([N+](=O)[O-])C=C1 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CCN(C)C(=O)N1C(C2=CC=NN2C2=CC=C(C#N)C=C2)=C(C)N(C2=CC=CC(C(F)(F)F)=C2)C1=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC(C)(C)S(=O)N=C(C1=CC=C(F)C(Br)=C1)C1=CC=CC(F)=C1C#N.FC(F)(F)C1=CC(Br)=CC=N1 ",
"input": "",
"output": " NC1=NC(C2=CC=NC(C(F)(F)F)=C2)(C2=CC=C(F)C(Br)=C2)C2=CC=CC(F)=C12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC(=O)O.CC(C)=O.CCO.CCOC(=O)C(CCC=C(C)C)C(C)=O.[BH4-].[Na+] ",
"input": "",
"output": " CCOC(=O)C(CCC=C(C)C)C(C)O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CCOC(=O)C1=CN=C(NC2=CC3=C4C(=C2)CCCC4CCC3)N=C1.CI.CN(C)C=O.[Cl-].[H-].[NH4+].[Na+] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CN(C1=CC2=C3C(=C1)CCCC3CCC2)C1=NC=C(C(=O)O)C=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1=CC=C([PH](C2=CC=CC=C2)(C2=CC=CC=C2)[Pd]([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)[PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.C1CCOC1.C=CCOC1=CC(Cl)=C(CC2=CC=C(OCC)C=C2)C=C1[C@@H]1O[C@H](COC(C)=O)[C@@H](OCC2=CC=CC=C2)[C@H](OCC2=CC=CC=C2)[C@H]1OCC1=CC=CC=C1.CCOC(C)=O.[BH4-].[Na+] as the reactants and reagents.",
"input": "",
"output": " CCOC1=CC=C(CC2=CC([C@@H]3O[C@H](COC(C)=O)[C@@H](OCC4=CC=CC=C4)[C@H](OCC4=CC=CC=C4)[C@H]3OCC3=CC=CC=C3)=C(O)C=C2Cl)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: COC1=CC(OC)=C(Cl)C(C2=CC3=C(C=N2)C(C2=CN(CC(=O)O)N=C2)=NN3)=C1Cl.Cl.F[C@H]1CCNC1 .",
"input": "",
"output": " COC1=CC(OC)=C(Cl)C(C2=CC3=C(C=N2)C(C2=CN(CC(=O)N4CC[C@H](F)C4)N=C2)=NN3)=C1Cl ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1CCOC1.CCCCP(CCCC)CCCC.COC1=CC=C(CN(C2=CC=CC(F)=N2)S(=O)(=O)C2=CC3=C(C=C2C)NN=C3)C(OC)=C1.C[C@H](O)C1=CC=CC2=C1CN(C(=O)OC(C)(C)C)CC2 ",
"input": "",
"output": " COC1=CC=C(CN(C2=CC=CC(F)=N2)S(=O)(=O)C2=CC3=C(C=C2C)N([C@H](C)C2=CC=CC4=C2CN(C(=O)OC(C)(C)C)CC4)N=C3)C(OC)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CCN(CC)C(=O)CCl.CN(C)C=O.COC(=O)C1=CC(Cl)=C(N)C=C1O.[H-].[Na+] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CCN(CC)C(=O)COC1=CC(N)=C(Cl)C=C1C(=O)OC ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC1=NN(C2=CC(OS(C)(=O)=O)=C(Cl)C=C2F)C(C)=C1[N+](=O)[O-].CCO.Cl.[Na+].[OH-] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CC1=NN(C2=CC(O)=C(Cl)C=C2F)C(C)=C1[N+](=O)[O-] .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CC(C)(C)OC(=O)N[C@@H]1CCNC1.CN(C)C=O.ICC12CCC(CC1)O2.O.O=C([O-])[O-].[K+] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CC(C)(C)OC(=O)N[C@@H]1CCN(CC23CCC(CC2)O3)C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CC(=O)NCCC1=CC=C(Cl)C=C1.O=P12OP3(=O)OP(=O)(O1)OP(=O)(O2)O3 as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CC1=NCCC2=CC=C(Cl)C=C12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC1=CC(C(=O)C2=CNC3=CC=CC=C3C2=O)=CN=C1C.CC1=CC=CC(CBr)=N1.CN(C)C=O.[H-].[Na+] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CC1=CC=CC(CN2C=C(C(=O)C3=CN=C(C)C(C)=C3)C(=O)C3=CC=CC=C32)=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CCN(CC)CC1=C(C)C=C(C(=O)O)S1.COC1=CC(O)=CC=C1C(=N)NO ",
"input": "",
"output": " CCN(CC)CC1=C(C)C=C(C2=NC(C3=CC=C(O)C=C3OC)=NO2)S1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C=O.CCN1CN(C)CN(C2=NC3=CC=C([N+](=O)[O-])C=C3S2)C1=O.CCNC(=O)NC1=NC2=CC=C([N+](=O)[O-])C=C2S1.CCO.CN.CN1CCOCC1.CO.O as the reactants and reagents.",
"input": "",
"output": " N#CC1=CC=C2N=C(NC(=O)NCC3=CC=CN=C3)SC2=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CN1CCN(CC2=CC([N+](=O)[O-])=CC=C2C(F)(F)C(F)(F)F)CC1.NC1=CC=C(C(F)(F)C(F)(F)F)C(OCCN2CCCC2)=C1 Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CN1CCN(CC2=CC(N)=CC=C2C(F)(F)C(F)(F)F)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)(C)OC(=O)NC1=CC=C(C2=CC(F)=CC=C2F)C=C1N.CC1(C)OC(=O)C=C(C2=CC=CC(C#N)=C2)O1 Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CC(C)(C)OC(=O)NC1=CC=C(C2=CC(F)=CC=C2F)C=C1NC(=O)CC(=O)C1=CC=CC(C#N)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC1=C(CCC2=NC=C(C(=O)O)S2)C(C2=CC=CC=N2)=NO1.NC1CCS(=O)(=O)C1 Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CC1=C(CCC2=NC=C(C(=O)NC3CCS(=O)(=O)C3)S2)C(C2=CC=CC=N2)=NO1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC1(C)OB(C2=CC(Cl)=C(O)C(Cl)=C2)OC1(C)C.CN(C)CC1=CC=C(NC2=C(S(C)(=O)=O)C=NC3=CC=C(Br)C=C23)C=C1 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CN(C)CC1=CC=C(NC2=C(S(C)(=O)=O)C=NC3=CC=C(C4=CC(Cl)=C(O)C(Cl)=C4)C=C23)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CC(=O)NC1=CC=CC2=C1CCC(=O)C2.Cl.NCC1=CC=CO1 as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CC(=O)NC1=CC=CC2=C1CCC(NCC1=CC=CO1)C2 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC(=O)C1=CC2=C(C=C1N)OCO2.CC(=O)C1=CC=C(C(=O)O)C=C1.CS(=O)(=O)C1=CC=C(NCC2=CC=C(C(=O)NC3=CC=CC=C3N)C=C2)C=C1 as the reactants and reagents.",
"input": "",
"output": " CC(=O)C1=CC2=C(C=C1NC(C)C1=CC=C(C(=O)NC3=CC=CC=C3N)C=C1)OCO2 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(=O)O.CC(C)CCON=O.CCOC(=O)C[C@@H](CC1=CC=C(N)C(C)=C1COC(C)=O)C(=O)OCC.ClC(Cl)Cl.ClCCl Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CCOC(=O)C[C@@H](CC1=CC=C2NN=CC2=C1COC(C)=O)C(=O)OCC .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: COC1=CC(C(=O)N2CC3=CC=C(C(=O)C(Cl)(Cl)Cl)N3CC3=CC=CC=C32)=CC=C1C1=CC=CC=C1C.NCCC(C1=CC=CC=C1)C1=CC=CC=C1 .",
"input": "",
"output": " COC1=CC(C(=O)N2CC3=CC=C(C(=O)NCCC(C4=CC=CC=C4)C4=CC=CC=C4)N3CC3=CC=CC=C32)=CC=C1C1=CC=CC=C1C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1CCOC1.CO.COC(=O)C1=CC(C)=C(OCC(C2=C3C=C(F)C(F)=CC3=NN2C2=CC=C(Cl)C=C2)C2CCCCC2)C(C)=C1.[Li+].[OH-] ",
"input": "",
"output": " CC1=CC(C(=O)O)=CC(C)=C1OCC(C1=C2C=C(F)C(F)=CC2=NN1C1=CC=C(Cl)C=C1)C1CCCCC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC(=O)O.CCO.CCOC(=O)CC1CCC2=CC(NC(=O)C3=CC=C(C=NN)C=C3Cl)=CC=C2O1.Cl.[Na+].[OH-] , what product could potentially be produced?",
"input": "",
"output": "The product can be NN=CC1=CC=C(C(=O)NC2=CC=C3OC(CC(=O)O)CCC3=C2)C(Cl)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with BrCCCCCCCCBr.CN(C)C=O.O.O=C([O-])[O-].O=CC1=CC=C(O)C=C1.[K+] as the reactants and reagents.",
"input": "",
"output": " CCCCC(C=O)CCCOC1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CCN(CC)CC.CNC1=CC=CC=N1.COC1=CC2=NC=NC(OC3=CC=C(N)C(Cl)=C3)=C2C=C1OC.ClC(Cl)Cl.O=C(OC(Cl)(Cl)Cl)OC(Cl)(Cl)Cl.O=C([O-])O.[Na+] as the reactants and reagents.",
"input": "",
"output": " COC1=CC2=NC=NC(OC3=CC=C(NC(=O)NCC4=CC=CC=N4)C(Cl)=C3)=C2C=C1OC ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CCN(CC)CC.ClCCl.NC1=CC=CC=C1C1=CC=C(COC2CCCCO2)C=C1.O=C(OC(Cl)(Cl)Cl)OC(Cl)(Cl)Cl , what product could potentially be produced?",
"input": "",
"output": "The product can be O=C=NC1=CC=CC=C1C1=CC=C(COC2CCCCO2)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)[C@H](NC(=O)OC(C)(C)C)C1=NC=C(C2=CC=C(C3=CC=C(C4=CN=C([C@@H]5CCCN5C(=O)OC(C)(C)C)N4)C=C3)C=C2)N1.ClCCl.O=C(O)C(F)(F)F Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CC(C)[C@H](N)C1=NC=C(C2=CC=C(C3=CC=C(C4=CN=C([C@@H]5CCCN5)N4)C=C3)C=C2)N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.CSC1=NC(C)=C(Cl)C(CS(C)(=O)=O)=N1.C[C@@H]1NC(=O)O[C@@H]1C1=CC(C(F)(F)F)=CC(C(F)(F)F)=C1.[Cl-].[H-].[NH4+].[Na+] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CSC1=NC(C)=C(Cl)C(CN2C(=O)O[C@H](C3=CC(C(F)(F)F)=CC(C(F)(F)F)=C3)[C@@H]2C)=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CC=NC=C1.CC(C)C1=CC2=C(NC3=CC=CC=C3N=C2N)S1.COCC[C@H]1CNCCN1.Cl Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be COCC[C@H]1CN(C2=NC3=CC=CC=C3NC3=C2C=C(C(C)C)S3)CCN1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CN(CC(=O)N[C@H]1CCN(C(=O)[C@@H]2C[C@H](S)CN2C(=O)OCC2=CC=C([N+](=O)[O-])C=C2)C1)C(=NC(=O)OCC1=CC=C([N+](=O)[O-])C=C1)NC(=O)OCC1=CC=C([N+](=O)[O-])C=C1.C[C@@H](O)[C@H]1C(=O)N2C(C(=O)OCC3=CC=C([N+](=O)[O-])C=C3)=C(OP(=O)(C3=CC=CC=C3)C3=CC=CC=C3)[C@H](C)[C@H]12 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: C[C@@H](O)[C@H]1C(=O)N2C(C(=O)OCC3=CC=C([N+](=O)[O-])C=C3)=C(S[C@H]3C[C@@H](C(=O)N4CC[C@H](NC(=O)CN(C)C(=NC(=O)OCC5=CC=C([N+](=O)[O-])C=C5)NC(=O)OCC5=CC=C([N+](=O)[O-])C=C5)C4)N(C(=O)OCC4=CC=C([N+](=O)[O-])C=C4)C3)[C@H](C)[C@H]12 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: BrC1=CN=CN=C1.CC1(C)C2=CC=CC(P(C3=CC=CC=C3)C3=CC=CC=C3)=C2OC2=C(P(C3=CC=CC=C3)C3=CC=CC=C3)C=CC=C21.CN(C)C(=O)C1=CC(Br)=CC=C1N.O=C(/C=C/C1=CC=CC=C1)/C=C/C1=CC=CC=C1.O=C([O-])[O-].[Cs+].[Pd] .",
"input": "",
"output": " CN(C)C(=O)C1=CC(Br)=CC=C1NC1=CN=CN=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.CCCC[N+](CCCC)(CCCC)CCCC.CCOC(C)=O.COC(=O)CC1=CC=C(C(F)(F)F)C=C1C#C[Si](C)(C)C.[F-] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be C#CC1=CC(C(F)(F)F)=CC=C1CC(=O)OC .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CC=C([PH](C2=CC=CC=C2)(C2=CC=CC=C2)[Pd]([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)[PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.C1COCCO1.CC(=O)OCC1=C(B2OC(C)(C)C(C)(C)O2)C=CC=C1N1CC2=CC(C(C)(C)C)=CC=C2C1=O.CCOC(C)=O.CN(C)C=O.CN1N=C(Cl)C=C(NC2=CC=CC=N2)C1=O.O.O=C([O-])[O-].[Li+].[Na+].[OH-] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CN1N=C(C2=CC=CC(N3CC4=CC(C(C)(C)C)=CC=C4C3=O)=C2CO)C=C(NC2=CC=CC=N2)C1=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC[N+](CC)(CC)CC1=CC=CC=C1.COC1=CC=C(S(=O)(=O)Cl)C=C1.ClCCl.O=C1C2=CC=CC=C2N=C(C2=CN=C3NC=CC3=C2)N1C1=CC=C(Cl)C=C1.[Cl-].[Na+].[OH-] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " COC1=CC=C(S(=O)(=O)N2C=CC3=CC(C4=NC5=CC=CC=C5C(=O)N4C4=CC=C(Cl)C=C4)=CN=C32)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C1=CNC=N1.CC1=CSC2=NC(Cl)=NC(NCC3=CC=C4OCCOC4=C3)=C12 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC1=CSC2=NC(N3C=CN=C3)=NC(NCC3=CC=C4OCCOC4=C3)=C12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1=CC=C([PH](C2=CC=CC=C2)(C2=CC=CC=C2)[Pd]([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)[PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.CC1=CC=CC=C1.CCO.COC(=O)C1=CC2=CC(Br)=CC=C2S(=O)(=O)CC1.O.O=C([O-])[O-].[K+].[O-]B([O-])OC1=CC=C(OC(F)(F)F)C=C1 ",
"input": "",
"output": " COC(=O)C1=CC2=CC(C3=CC=C(OC(F)(F)F)C=C3)=CC=C2S(=O)(=O)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CC1=CC=C(O)C=N1.Cl.OO as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CC1=CC=C(O)C(Cl)=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CC1=CC=CC=C1.CCCC[Sn](=O)CCCC.COC1=CC=C(C2=CN(C(=O)N(C)C3CCN(C#N)CC3)C=N2)C=C1.C[Si](C)(C)N=[N+]=[N-] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " COC1=CC=C(C2=CN(C(=O)N(C)C3CCN(C4=NNN=N4)CC3)C=N2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1COCCO1.C=C[C@@H]1C[C@]1(NC(=O)[C@@H]1C[C@@H](O)CN1C(=O)OC(C)(C)C)C(=O)OCC.Cl ",
"input": "",
"output": " C=C[C@@H]1C[C@]1(NC(=O)[C@@H]1C[C@@H](O)CN1)C(=O)OCC ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C=CC#N.CC(=O)[O-].CC1=CC=CC=C1P(C1=CC=CC=C1C)C1=CC=CC=C1C.CN(C)C=O.COC(=O)C1=CC(Cl)=CC=C1Br.C[Si](C)(C)C=[N+]=[N-].[Na+].[Pd+2] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " COC(=O)C1=CC(Cl)=CC=C1/C=C/C#N ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC(C)C(=O)Cl.CCCN1C(CCOC)=NC2=C(N)N=C3C=C(OC4CCNCC4)C=CC3=C21.ClC(Cl)Cl.O.O=C([O-])[O-].[Na+] ",
"input": "",
"output": " CCCN1C(CCOC)=NC2=C(N)N=C3C=C(OC4CCN(C(=O)C(C)C)CC4)C=CC3=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CNC(=O)CCl.O=C(C1=CNC2=CC(Cl)=CC=C12)N1CCC(C2=CC=CC=C2C(F)(F)F)CC1 ",
"input": "",
"output": " CNC(=O)CN1C=C(C(=O)N2CCC(C3=CC=CC=C3C(F)(F)F)CC2)C2=CC=C(Cl)C=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C=CCCCCCC(CCCCCCC(F)(F)C(F)(F)F)(C(=O)OC)C(=O)OC.CCCCCC.CCOC(C)=O.CS(C)=O.O.[Cl-].[Li+] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: C=CCCCCCC(CCCCCCC(F)(F)C(F)(F)F)C(=O)OC .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CCN(C(C)C)C(C)C.CCOC(C)=O.CN(C)C=O.COC1=CC(C(=O)CN2C(C3=NON=C3N)=NC3=CC=CC=C32)=CC=C1O.COCCl as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " COCOC1=CC=C(C(=O)CN2C(C3=NON=C3N)=NC3=CC=CC=C32)C=C1OC ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C1CCOC1.CO.COC1CCC(OC)O1.CSC1=CC=C(Cl)C=C1N.O.O=S(=O)(O)O.[BH4-].[Na+].[OH-] .",
"input": "",
"output": " CSC1=CC=C(Cl)C=C1N1CCCC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(=O)O.CC1=CC=CC=C1.CN(C1CCN(C(=O)OC(C)(C)C)CC1)C1([C@@H]2CCN(CC3=CC=CC=C3)C2)CC1 Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CN(C1CCN(C(=O)OC(C)(C)C)CC1)C1([C@@H]2CCNC2)CC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC1=CSC=N1.CCOCC.C[Si](C)(C)Cl.[Li]CCCC ",
"input": "",
"output": " CC1=CSC([Si](C)(C)C)=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC#N.CC1=NC(C(=O)N2CCC[C@@H](C)[C@H]2CN)=C(C2=CC=C(F)C=C2)S1.CCN(C(C)C)C(C)C.FC1=CC=C2OC(Cl)=NC2=C1 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC1=NC(C(=O)N2CCC[C@@H](C)[C@H]2CNC2=NC3=CC(F)=CC=C3O2)=C(C2=CC=C(F)C=C2)S1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CCN(CC)CC.CS(=O)(=O)Cl.ClCCl.O=CC1=CC=C2C=CC(CO)=CC2=C1.[Cl-].[NH4+] ",
"input": "",
"output": " CS(=O)(=O)OCC1=CC=C2C=CC(C=O)=CC2=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCOC1=C(OC)C=C(B(O)O)C=C1OC.CCOC1=C(OC)C=C(I)C=C1OC.COC1=CC(I)=CC(OC)=C1OCC(F)(F)F Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be COC1=CC(B(O)O)=CC(OC)=C1OCC(F)(F)F .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CCO.COC1=CC=C2OCCCC(=O)C2=C1.Cl.NO.O.O=C([O-])[O-].[Na+] as the reactants and reagents.",
"input": "",
"output": " COC1=CC=C2OCCCC(=NO)C2=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC1(C)NN(C2C3CC4CC(C3)CC2C4)C1=O.O=S(=O)(Cl)C1=CC=CC(Cl)=C1 Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CC1(C)C(=O)N(C2C3CC4CC(C3)CC2C4)N1S(=O)(=O)C1=CC=CC(Cl)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCN.ClCCl.ClP(Cl)(Cl)(Cl)Cl.O=C(O)C1=C2CN=C(C3=CC=CC=C3Br)C3=CC(F)=CC=C3N2C=N1.O=C([O-])[O-].[Na+] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CCNC(=O)C1=C2CN=C(C3=CC=CC=C3Br)C3=CC(F)=CC=C3N2C=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)(C)[Si](C)(C)O[C@H]1CC[C@]2(C)C3=CC[C@]4(C)[C@@H](O[Si](C)(C)C(C)(C)C)CC[C@H]4[C@@H]3CC[C@]2(CCI)C1.CN(C)C=O.[C-]#N.[K+] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CC(C)(C)[Si](C)(C)O[C@H]1CC[C@]2(C)C3=CC[C@]4(C)[C@@H](O[Si](C)(C)C(C)(C)C)CC[C@H]4[C@@H]3CC[C@]2(CCC#N)C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CC=NC=C1.CC1=CC=C(S(=O)(=O)Cl)C=C1.COC1=CC(CCO)=CC=C1OC(C)=O.O Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be COC1=CC(CCOS(=O)(=O)C2=CC=C(C)C=C2)=CC=C1OC(C)=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CO.COC1=CC=C(C(O)C2COC(C)(C)N2C(=O)OCC2=CC=CC=C2)C=C1 as the reactants and reagents.",
"input": "",
"output": " COC1=CC=C([C@@H](O)[C@@H](CO)NC(=O)OCC2=CC=CC=C2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC(C)(C)OC(=O)NCC1=NC=C(C2=CC=C([C@@H](O)[C@@H](CF)NC(=O)C(Cl)Cl)C=C2)O1.ClCCl.O=C(O)C(F)(F)F ",
"input": "",
"output": " NCC1=NC=C(C2=CC=C([C@@H](O)[C@@H](CF)NC(=O)C(Cl)Cl)C=C2)O1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CCOC(=O)C1=CC=CC=C1NO.ClCC1=NC2=CC=CC=C2S1 as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CCOC(=O)C1=CC=CC=C1NOCC1=NC2=CC=CC=C2S1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC(=O)O.CC(=O)[O-].ClI.FC(F)(F)C1=CC=C(C2=NC3=CC=NN3C(C(F)(F)F)=C2)C=C1.O.[Na+] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: FC(F)(F)C1=CC=C(C2=NC3=C(I)C=NN3C(C(F)(F)F)=C2)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC1=CC=C(S(=O)(=O)O)C=C1.CC1=CC=CC=C1C.CCCC1=C(OCC2=CC=CC=C2)C=CC(C(C)=O)=C1O.CCO.CCOCC.CO.COC(OC)N(C)C.O ",
"input": "",
"output": " CCCC1=C(OCC2=CC=CC=C2)C=CC2=C1OC=CC2=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC(C)C[C@H](N)C(N)=O.O=C(O)C1=CC=C(C2(O)COC2)C(OCC2CC2)=N1 as the reactants and reagents.",
"input": "",
"output": " CC(C)C[C@H](NC(=O)C1=CC=C(C2(O)COC2)C(OCC2CC2)=N1)C(N)=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCN1N=C(C2=CC=CC=C2)C(C(C)=O)=C([N+](=O)[O-])C1=O.CCO.NC1=CC=CC(Cl)=C1 Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CCN1N=C(C2=CC=CC=C2)C(C(C)=O)=C(NC2=CC=CC(Cl)=C2)C1=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1CCOC1.CC(C)[Mg]Br.FC(F)(F)C1=CC=C(Br)C=N1.O=C1CCOC2=CC=CN=C12.[Cl-].[NH4+] ",
"input": "",
"output": " OC1(C2=CC=C(C(F)(F)F)C=C2)CCOC2=CC=CN=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C1=CC=C(P(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.C=CCOC(=O)C1=C(C(=O)OC(C)(C)C)N2C(=O)[C@@H](NC(=O)OC(C)(C)C)[C@H]2CC1.CC#N.CCCC[SnH](CCCC)CCCC.CCOCC.Cl.ClC(Cl)Cl.O is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC(C)(C)OC(=O)N[C@@H]1C(=O)N2C(C(=O)OC(C)(C)C)=C(C(=O)O)CC[C@H]12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1CCOC1.CC(=O)[O-].COC1=CC=CC(C2=CC(OS(=O)(=O)C(F)(F)F)=NC(CC(=O)N3CCOCC3)=N2)=C1.NC1=CC=CN=C1.O=C([O-])[O-].[Cs+].[Pd+2] as the reactants and reagents.",
"input": "",
"output": " COC1=CC=CC(C2=CC(NC3=CC=CN=C3)=NC(CC(=O)N3CCOCC3)=N2)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.CC(C)NC(C)C.CN(C)C=O.FC1=CC=CC=N1.[Li]CCCC Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be O=CC1=CC=CN=C1F .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CN(C)C=O.CS(=O)C1=NC(Cl)=C2C=CC(=O)N(C3=CC=C(F)C=C3F)C2=N1.ClCCl.NC(CO)CO .",
"input": "",
"output": " O=C1C=CC2=C(Cl)N=C(NC(CO)CO)N=C2N1C1=CC=C(F)C=C1F ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C#CCCCCCCCCCCCC.CCOC(OCC)OCC.[I-].[Zn+2] .",
"input": "",
"output": " CCCCCCCCCCCCC#CC(OCC)OCC ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if BrC1=CC=C2C=CC=CC2=N1.C1CCOC1.CC(C)(C)OC(=O)N1CCC(=O)CC1.CCCCCC.[Li]CCCC is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC(C)(C)OC(=O)N1CCC(O)(C2=CC=C3C=CC=CC3=N2)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCC2=NCCCN2CC1.CC1=CC=CC=C1.COC1=CC=C(C(C)O)C=C1OCC1=CC=CC=C1.[N-]=[N+]=NP(=O)(C1=CC=CC=C1)C1=CC=CC=C1 Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " COC1=CC=C(C(C)N=[N+]=[N-])C=C1OCC1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CCC1=CN=CC=C1C.ClC1=CC=CC(CCBr)=C1 as the reactants and reagents.",
"input": "",
"output": " CCC1=CN=CC=C1CCCC1=CC=CC(Cl)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CCN(CC)CC.COC(=O)[C@@H]1CCCN1.Cl.ClCCl.O=C(O)C1=C(F)C=CC([N+](=O)[O-])=C1F.O=C([O-])O.O=S(Cl)Cl.[Na+] ",
"input": "",
"output": " COC(=O)[C@@H]1CCCN1C(=O)C1=C(F)C=CC([N+](=O)[O-])=C1F ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " NC(=S)C1=CC=CC(Cl)=C1.O=C1C2=CC=C(Cl)C=C2CC1Br Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be Br.OC12N=C(C3=CC=CC(Cl)=C3)SC1CC1=CC(Cl)=CC=C12 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C#CC1=C2N=C(C3=CC=C(C(F)(F)F)C=C3)C=C(C(F)(F)F)N2N=C1.CC(C)(CO)NS(=O)(=O)C1=CC=CC(Br)=C1 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CC(C)(CO)NS(=O)(=O)C1=CC=CC(C#CC2=C3N=C(C4=CC=C(C(F)(F)F)C=C4)C=C(C(F)(F)F)N3N=C2)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCCC[N+](CCCC)(CCCC)CCCC.CCN=C=NCCCN(C)C.CCOC(C)=O.CN(C)C=O.CN1CCNCC1.CN1CCOCC1.CO.COC(=O)C1=CC=C(CCl)C=C1C1=CC=CC=C1.COC(=O)[C@@H](N)CCSC.Cl.O=C([O-])[O-].O=C1C2=CC=CC=C2N=NN1O.[Br-].[K+] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be COC(=O)[C@H](CCSC)NC(=O)C1=CC=C(CN2CCN(C)CC2)C=C1C1=CC=CC=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1CCOC1.CCN(CC)CC.NC(=O)N1C=C(N=C=O)C2=CC=CC=C21.O.O=C(N[C@@H]1CN[C@H](C(=O)OCC2=CC=CC=C2)C1)OCC1C2=CC=CC=C2C2=CC=CC=C21 ",
"input": "",
"output": " NC(=O)N1C=C(NC(=O)N2C[C@@H](NC(=O)OCC3C4=CC=CC=C4C4=CC=CC=C43)C[C@H]2C(=O)OCC2=CC=CC=C2)C2=CC=CC=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with COC(=O)NC[C@@H]1CN(C(=O)OC(C)(C)C)CCO1.ClCCl.O=C(O)C(F)(F)F as the reactants and reagents.",
"input": "",
"output": " COC(=O)NC[C@@H]1CNCCO1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C1=CC=NC=C1.CC(C)(C)[Si](C)(C)O[C@H]1C=CC(=O)C1.Cl.ClCCl.II is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC(C)(C)[Si](C)(C)O[C@H]1C=C(I)C(=O)C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C/C=C\\C1=C(C(=O)O)N2C(=O)C(NC(=O)/C(=N\\OC(C3=CC=CC=C3)(C3=CC=CC=C3)C3=CC=CC=C3)C3=CSC(N)=N3)[C@H]2SC1.CC(=O)OC(C)Br.CN(C)C=O.O=C([O-])O.O=C([O-])[O-].[K+].[Na+] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " C/C=C\\C1=C(C(=O)OC(C)OC(C)=O)N2C(=O)C(NC(=O)/C(=N\\OC(C3=CC=CC=C3)(C3=CC=CC=C3)C3=CC=CC=C3)C3=CSC(N)=N3)[C@H]2SC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C1COCCO1.CC(=O)N1CCN(C2=CC(C)=C3N=C(C4=C(N[C@H](CO)CC5=CC=CC=C5)C=CNC4=O)NC3=C2)CC1.Cl.O as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CC1=CC(N2CCNCC2)=CC2=C1N=C(C1=C(N[C@H](CO)CC3=CC=CC=C3)C=CNC1=O)N2 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CCC1=CC=C(C(=O)O)C(N)=C1.CCO.Cl ",
"input": "",
"output": " CCOC(=O)C1=CC=C(CC)C=C1N ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)CN1N=C(C2=CC=C(C(F)(F)F)C=C2)C=C(COS(C)(=O)=O)C1=O.CC1=CC=C(C2=NN(CC(C)C)C(=O)C(N3CCN(C(=O)OC(C)(C)C)CC3)=C2C)C=C1F.CN1CCNCC1 Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CC1=C(N2CCN(C)CC2)C(=O)N(CC(C)C)N=C1C1=CC=C(C(F)(F)F)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC(C)(C)C1=NN(C2=CC=CC(OCCOC3CCCCO3)=C2)C(NC(=O)N[C@H]2CC[C@@H](OC3=CN4C(N5CCCCC5)=NN=C4C=C3)C3=CC=CC=C32)=C1.CCN(C(C)C)C(C)C.CS(=O)(=O)Cl.ClCCl is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC(C)(C)C1=NN(C2=CC=CC(OCCOS(C)(=O)=O)=C2)C(NC(=O)N[C@H]2CC[C@@H](OC3=CN4C(N5CCCCC5)=NN=C4C=C3)C3=CC=CC=C32)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) BrC(Br)(Br)Br.C1=CC=C(P(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.CCCCCC.ClCCl.O.O=CCCC(F)(F)F as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: FC(F)(F)CCC=C(Br)Br .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1CCOC1.O=C(O)C1=CC=C(OCC2CC2)C(C(F)(F)F)=C1.O=C([O-])O.[Na+] ",
"input": "",
"output": " OCC1=CC=C(OCC2CC2)C(C(F)(F)F)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses COC(=O)C1=CC=NC(Cl)=C1CBr.COC1=CC(C(C)N)=CN=C1OCC(F)(F)F.Cl as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: COC1=CC(C(C)N2CC3=C(C=CN=C3Cl)C2=O)=CN=C1OCC(F)(F)F .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C1=CC=C(P(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.C1CCOC1.CC(C)OC(=O)/N=N/C(=O)OC(C)C.CC1=NC(C(=O)N2CC3CCCC3C2CO)=C(C2=CC=C(F)C=C2)S1.O=C1NC(=O)C2=CC=CC=C12 .",
"input": "",
"output": " CC1=NC(C(=O)N2CC3CCCC3C2CN2C(=O)C3=CC=CC=C3C2=O)=C(C2=CC=C(F)C=C2)S1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C1=CC=NC=C1.CC1(C)C2CCC1(CN)CC2.CCOCC.O=C(Br)CBr as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CC1(C)C2CCC1(CNC(=O)CBr)CC2 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) COC(=O)C12CC3CC(CC(N)(C3)C1C(=O)[C@H](CC1=CC=CC=C1)NC(=O)CN)C2.COC(=O)C12CC3CC(CC(N)(C3)C1C(=O)[C@H](CC1=CC=CC=C1)NC(=O)CNC(=O)OC(C)(C)C)C2.COC(=O)C12CC3CC(CC(N)(C3)C1C(=O)[C@H](CC1=CC=CC=C1)NC(=O)CNC(=O)[C@@H](CCSC)NC(=O)C(CC1=C(C)C=C(O)C=C1C)NC(=O)OC(C)(C)C)C2.COC(=O)[C@H](N)CCSC.CSCC[C@@H](NC(=O)C(CC1=C(C)C=C(O)C=C1C)NC(=O)OC(C)(C)C)C(=O)O.Cl as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: COC(=O)C12CC3CC(CC(N)(C3)C1C(=O)[C@H](CC1=CC=CC=C1)NC(=O)CNC(=O)[C@@H](CCSC)NC(=O)C(N)CC1=C(C)C=C(O)C=C1C)C2 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C1CCCCC1.C1CCOC1.CCCCCC.CCCCOC1CC=C(C2=CC=CC(F)=C2F)CC1.CCOC(C)=O.COB(OC)OC.Cl.[Li]C(C)CC as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CCCCOC1CC=C(C2=CC=C(B(O)O)C(F)=C2F)CC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC(C)(C)OC(=O)C(CNC(=O)C1=NC(C#N)=C2C=C(OC3=CC=CC=C3)C=CC2=C1O)C1CC1.CCOC(C)=O.ClCCl.O=C(O)C(F)(F)F as the reactants and reagents.",
"input": "",
"output": " N#CC1=NC(C(=O)NCC(C(=O)O)C2CC2)=C(O)C2=CC=C(OC3=CC=CC=C3)C=C12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1=CC=C(CN2CCNCC2)C=C1.C1CCOC1.CCN(CC)CC.CCN=C=NCCCN(C)C.Cl.O=C(O)CC1=CC2=CC=CC=C2N1.ON1N=NC2=CC=CC=C21 as the reactants and reagents.",
"input": "",
"output": " O=C(CC1=CC2=CC=CC=C2N1)NN1CCN(CC2=CC=CC=C2)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.CC(=O)O.CC(C)NC(C)C.CC(C)[N-]C(C)C.CCCCCC.CN(C)C=O.N#CC1=CC=C(F)C=C1Cl.O.[Cl-].[Li+].[Li]CCCC.[Na+] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be N#CC1=CC=C(F)C(C=O)=C1Cl .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC1=CC=CC(C2=NCCN2C)=C1[N+](=O)[O-].CCO.[OH-].[Pd+2] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CC1=CC=CC(C2=NCCN2C)=C1N ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CCC1=CC=C(S(=O)(=O)Cl)C(CC)=C1.CCN(CC)CC.O=C(C1=CC=C(NC2=CC=NC3=CC(C(F)(F)F)=CC=C23)C=C1)N1CCNCC1 .",
"input": "",
"output": " CCC1=CC=C(S(=O)(=O)N2CCN(C(=O)C3=CC=C(NC4=CC=NC5=CC(C(F)(F)F)=CC=C45)C=C3)CC2)C(CC)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC1=CC(CO)=CC(C)=N1.ClC(Cl)Cl.O=S(Cl)Cl Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CC1=CC(CCl)=CC(C)=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C=CC(C)=O.CO.O=C(OCC1=CC=CC=C1)N1CCC[C@@H]1CC1=CNC2=CC=C(Br)C=C12 .",
"input": "",
"output": " CC(=O)C=CC1=CC=C2NC=C(C[C@H]3CCCN3C(=O)OCC3=CC=CC=C3)C2=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CI.CN(C)C=O.COC1=CC=C(CC(=O)C2=CC=C3C(=C2)N(C)C(=O)N3C)C(Cl)=C1.O.[H-].[Na+] ",
"input": "",
"output": " COC1=CC=C(C(C)C(=O)C2=CC=C3C(=C2)N(C)C(=O)N3C)C(Cl)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CN(C)C=O.COC1=CC=C(C(C)=O)C=C1C(=O)O.ClCCCl.ClCCl.NCC1=CC=C(C(F)(F)F)C=C1.ON1N=NC2=CC=CC=C21 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " COC1=CC=C(C(C)=O)C=C1C(=O)NCC1=CC=C(C(F)(F)F)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CC(C)(C)OC(=O)N[C@H]1CCN(C2=CC=C(N3C[C@H](CN(C(=O)OCC(Cl)(Cl)Cl)C4=NOC=C4)OC3=O)C=C2F)C1.CCO.Cl.ClCCl as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " N[C@H]1CCN(C2=CC=C(N3C[C@H](CN(C(=O)OCC(Cl)(Cl)Cl)C4=NOC=C4)OC3=O)C=C2F)C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC1(C)C2=CC=CC=C2C(C)(C)N1O.CC1=CC(C)=C(C(=O)Cl)C(C)=C1 ",
"input": "",
"output": " CC1=CC(C)=C(C(=O)ON2C(C)(C)C3=CC=CC=C3C2(C)C)C(C)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C1=CC=NC=C1.CC(=O)OC(C)=O.CC(C)(N)C(=O)O.O , what product could potentially be produced?",
"input": "",
"output": "The product can be CC(=O)NC(C)(C)C(=O)O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses COC(=O)NCCC(C1=CC=CC=C1)C1=CC=CC2=C1C=CN2.NCCC(C1=CC=CC=C1)C1=CC=C2C=CNC2=C1 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: COC(=O)NCCC(C1=CC=CC=C1)C1=CC=C2C=CNC2=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(=O)OC[C@H]1O[C@](O)(C2=CC=C(Cl)C(CC3=CC=C(OC4(CO)CCCC4)C=C3)=C2)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O.C[Si](C)(C)C=[N+]=[N-].ClCCl.F[B-](F)(F)F.[H+] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be COCC1(OC2=CC=C(CC3=CC([C@@]4(O)O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]4OC(C)=O)=CC=C3Cl)C=C2)CCCC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC(=O)O.ClC1=NC2=CC=CC=C2C=C1I.O ",
"input": "",
"output": " O=C1NC2=CC=CC=C2C=C1I ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C1CCOC1.CC(C)(C)S(N)=O.CCOC(C)=O.CC[O-].CO.N#CC1=CC=CC=C1C(=O)C1=CC=CC(Br)=C1.O=C([O-])O.[Na+].[Ti+4] , what product could potentially be produced?",
"input": "",
"output": "The product can be CC(C)(C)S(=O)N=C(C1=CC=CC(Br)=C1)C1=CC=CC=C1C#N .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: COCCCN.Cl.O=C(O)C1=CC=CC(C2=C3OC(C(=O)N[C@H]4CN5CCC4CC5)=CC3=CC=C2)=C1 , what product could potentially be produced?",
"input": "",
"output": "The product can be COCCCNC(=O)C1=CC=CC(C2=C3OC(C(=O)N[C@H]4CN5CCC4CC5)=CC3=CC=C2)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with COCCCN.Cl.O=C(O)C1=CC=CC(C2=C3OC(C(=O)N[C@@H]4CN5CCC4CC5)=CC3=CC=C2)=C1 as the reactants and reagents.",
"input": "",
"output": " COCCCNC(=O)C1=CC=CC(C2=C3OC(C(=O)N[C@@H]4CN5CCC4CC5)=CC3=CC=C2)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC(=O)O.CCO.COC(=O)C1=CC(S(=O)(=O)C2=CC=C(NCC3=CC=CC=N3)C([N+](=O)[O-])=C2)=C(SC)S1.O=CO.[Fe] ",
"input": "",
"output": " COC(=O)C1=CC(S(=O)(=O)C2=CC=C3C(=C2)N=CN3CC2=CC=CC=N2)=C(SC)S1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC1=CC(C)=C(C[P+](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C(C)=C1Cl.CCOC(=O)C=C(C)C=CC=C(C)C=O.[Cl-] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CCOC(=O)C=C(C)C=CC=C(C)C=CC1=C(C)C=C(C)C(Cl)=C1C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CC(C)(O)C#CC1=CN=C2OC3=CC(F)=C(Br)C=C3C3(COC(N)=N3)C2=C1.CO.CS(=O)(=O)O.O=C([O-])O.[Na+] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " COC(C)(C)C#CC1=CN=C2OC3=CC(F)=C(Br)C=C3C3(COC(N)=N3)C2=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCNC1.CS(=O)(=O)NN1C(=O)NC2=CC([N+](=O)[O-])=C(F)C=C2C1=O Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CS(=O)(=O)NN1C(=O)NC2=CC([N+](=O)[O-])=C(N3CCCC3)C=C2C1=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C1=C(N2CCOCC2)CCC1.C1=CC=CC=C1.COC1=CC=CC(C=O)=C1OC.Cl .",
"input": "",
"output": " COC1=CC=CC(C=C2CCCC2=O)=C1OC ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CC(=O)Cl.CNCC1=CC(C(=O)OC(C)(C)C)=CC=C1[C@H]1CC[C@H](NCC2=CC=CC=C2)CC1 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CNCC1=CC(C(=O)OC(C)(C)C)=CC=C1[C@H]1CC[C@H](N(CC2=CC=CC=C2)C(C)=O)CC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CO.O=CC1=CC=CC=C1OC1=CC=C(Cl)N=C1.[BH4-].[Na+] ",
"input": "",
"output": " OCC1=CC=CC=C1OC1=CC=C(Cl)N=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CNC(=O)C=C(C1=CC=CC=C1)C1=CC=C2C(OC)=NNC2=C1.CNCCC(C1=CC=CC=C1)C1=CC=CC2=C1NC=C2 Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CNCCC(C1=CC=CC=C1)C1=CC=C2C(OC)=NNC2=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC(=O)CC(C)=O.CC(=O)O.NC1=NC(NS(=O)(=O)C2=CC=CC=C2[N+](=O)[O-])=NN1 ",
"input": "",
"output": " CC1=NC2=NC(NS(=O)(=O)C3=CC=CC=C3[N+](=O)[O-])=NN2C(C)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC1=CC(F)=CN=C1C=O.CCO.[BH4-].[Na+] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CC1=CC(F)=CN=C1CO ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC(C)=O.CCN(CC)CC.CCOC(=O)C1CSCN1.Cl.ClC(Cl)Cl.ClCCl.O=C(Cl)C1=CC=C(NCCCCCCCCC2CCCCC2)C=C1.O=C(O)C1CSCN1.O=C([O-])O.[Na+] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: O=C(O)C1SCCN1C(=O)C1=CC=C(NCCCCCCCCC2CCCCC2)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC(C)CI.CCCCOC1=NC(N)=C2N=C(OC)N(CCCC3CCCCN3)C2=N1 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CCCCOC1=NC(N)=C2NC(=O)N(CCCC3CCCCN3CC(C)C)C2=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC1=C(CCN2CCNCC2)C=CC2=C1COC2=O.Cl.O=C1OCC2=C1C=CC(Br)=C2C(F)(F)F is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " O=C1OCC2=C1C=CC(CCN1CCNCC1)=C2C(F)(F)F ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CCC1=CC(B(O)O)=CC=C1CCCC(=O)NC1=CC=C(S(=O)(=O)C(C)C)C(CN(C)C(=O)OC(C)(C)C)=C1.NC(=O)C1=CC=CC(N)=C1.O.O=CC(=O)O ",
"input": "",
"output": " CCC1=CC(C(NC2=CC=CC(C(N)=O)=C2)C(=O)O)=CC=C1CCCC(=O)NC1=CC=C(S(=O)(=O)C(C)C)C(CN(C)C(=O)OC(C)(C)C)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CC(C)(C)OC(=O)N1CC[C@@H](ONC(=O)[C@@H]2CC[C@@H]3CN2C(=O)N3OCC2=CC=CC=C2)C1.CO.[H][H].[Pd] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CC(C)(C)OC(=O)N1CC[C@@H](ONC(=O)[C@@H]2CC[C@@H]3CN2C(=O)N3O)C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C1=CC=C([PH](C2=CC=CC=C2)(C2=CC=CC=C2)[Pd]([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)[PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.COC1=NC=CC=C1B(O)O.COCCOC.NC1=CC=CC(Br)=C1.O.O=C([O-])[O-].[Na+] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " COC1=NC=CC=C1C1=CC=CC(N)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC(=O)O.CC(=O)O[BH-](OC(C)=O)OC(C)=O.CN1CCNCC1.CO.ClCCl.O=CC1=CC=CC(C(=O)O)=N1.[Na+] ",
"input": "",
"output": " CN1CCN(CC2=CC=CC(C(=O)O)=N2)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CCOC(=O)[C@H](CC(C)C)NC(=O)C1=CC=C(N2CCC(NC[C@H](O)C3=CC=C(O)C(NS(C)(=O)=O)=C3)CC2)C=C1.[Na+].[OH-] as the reactants and reagents.",
"input": "",
"output": " CC(C)C[C@H](NC(=O)C1=CC=C(N2CCC(NC[C@H](O)C3=CC=C(O)C(NS(C)(=O)=O)=C3)CC2)C=C1)C(=O)O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CCO.CNC1=C(Cl)C(=O)N(C2CC(C)(C)CC(C)(C)C2)N=C1.[H][H].[Na+].[OH-].[Pd] .",
"input": "",
"output": " CNC1=CC(=O)N(C2CC(C)(C)CC(C)(C)C2)N=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCO.CCOC(=O)CC(C)=O.N#CC1=CC=CC(C=O)=C1.NC1=CC(N2CCOCC2)=NC(N2CCOCC2)=N1 Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CCOC(=O)C1=C(C)NC2=NC(N3CCOCC3)=NC(N3CCOCC3)=C2C1C1=CC=CC(C#N)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C=C(OCC)C1=CC2=C(C=C1C)OCCN1C=C(C3=NC(C)=NN3C(C)C)N=C21.CC(C)=O.CC1=CC=C(S(=O)(=O)O)C=C1 as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CC(=O)C1=CC2=C(C=C1C)OCCN1C=C(C3=NC(C)=NN3C(C)C)N=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC(C)(C)C1=NC(Cl)=C2N=NN(CC3=CC=CC=C3Cl)C2=N1.CC(C)(C)C1=NC(N2CCOCC2)=C2N=NN(CC3=CC=CC=C3Cl)C2=N1.NC[C@@H]1CCCN1 .",
"input": "",
"output": " CC(C)(C)C1=NC(N2CCC[C@H]2CN)=C2N=NN(CC3=CC=CC=C3Cl)C2=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CC=C2SC3=CC=CC=C3NC2=C1.C=CC#N.C=CCCCC.O=S(=O)(O)O Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be C=CC(=O)NC(C)CCCC .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C=CCBr.CC(C)=O.CC(O)C(=O)C1=CC=CC=C1.O=C([O-])[O-].[I-].[K+] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be C=CCOC(C)C(=O)C1=CC=CC=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC#N.CC[SiH](CC)CC.COC1=CC=C(C=O)C=N1.NC1=NC=C(C=O)C=N1.O=C(O)C(F)(F)F as the reactants and reagents.",
"input": "",
"output": " COC1=CC=C(CNC2=NC=C(C=O)C=N2)C=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCN(CC)CCCl.CCOC(C)=O.COC1=CC=C(C2=C(C(=O)C3=CC=C(O)C=C3)C3=CC=CC=C3S2)C=C1 Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CCN(CC)CCOC1=CC=C(C(=O)C2=C(C3=CC=C(OC)C=C3)SC3=CC=CC=C23)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C1=CN=C(N2CCNCC2)N=C1.O=C(O)C1=CC=C(C2=CN=C3NCCN(CC4=CC(Cl)=CC=C4C(F)(F)F)C3=C2)C=C1 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: O=C(C1=CC=C(C2=CN=C3NCCN(CC4=CC(Cl)=CC=C4C(F)(F)F)C3=C2)C=C1)N1CCN(C2=NC=CC=N2)CC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CCO.ClCC#CCCl.O.O=C([O-])[O-].O=C1CCC2=CC=C(O)C=C2N1.[K+] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: O=C1CCC2=CC=C(OCC#CCCl)C=C2N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C1=CC=C([PH](C2=CC=CC=C2)(C2=CC=CC=C2)[Pd]([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)[PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.CN(C)C=O.COC(=O)C1=CC=C([N+](=O)[O-])C=C1Br.O=C([O-])[O-].OB(O)C1=CC=CC2=CC=CC=C12.[K+] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: COC(=O)C1=CC=C([N+](=O)[O-])C=C1C1=CC=CC2=CC=CC=C12 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCN(CC)CC.CS(C)=O.ClCCl.O.O=C(NC1=N[C@@]2(C3=CC=C(F)C=C3F)CO[C@@H](CO)C[C@H]2CS1)C1=CC=CC=C1.[Cl-].[Na+] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be O=C[C@H]1C[C@H]2CSC(NC(=O)C3=CC=CC=C3)=N[C@@]2(C2=CC=C(F)C=C2F)CO1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C1=CC=C(P(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.C=CC(=O)OC.CC(=O)[O-].CCN(C(C)C)C(C)C.CN(C)C=O.OC1=NC(C2=CC=CN=C2)=NC2=CC=C(I)C=C12.[Pd+2] .",
"input": "",
"output": " COC(=O)C=CC1=CC=C2N=C(C3=CC=CN=C3)N=C(O)C2=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC1=CC=CC=C1.CCOC(=O)C1=NN=C(C)N1C1=CC=CC=C1C.Cl[Mg]CC1=CC=CC=C1.N.[Cl-] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CC1=CC=CC=C1N1C(C)=NN=C1C(=O)CC1=CC=CC=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C1CCOC1.CN1CCN2C1=CC(Cl)=NC2=O.OCC1=CC=C(OC2=CC=C(F)C(F)=C2)C(C(F)(F)F)=C1.[H-].[Na+] .",
"input": "",
"output": " CN1CCN2C1=CC(OCC1=CC=C(OC3=CC=C(F)C(F)=C3)C(C(F)(F)F)=C1)=NC2=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC1=CSC2=NC(C3=CN=CC=N3)=NC(Cl)=C12.NCC1=CC=CC=C1 Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CC1=CSC2=NC(C3=CN=CC=N3)=NC(NCC3=CC=CC=C3)=C12 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. C1=CC=C([PH](C2=CC=CC=C2)(C2=CC=CC=C2)[Pd]([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)[PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.CC1=CC(O[Si](C)(C)C(C)(C)C)=CC(C)=C1B(O)O.CC1=CC=CC=C1.CCO.CCOC(=O)CCC1=CC=C(N(C2CCC3=C(OS(=O)(=O)C(F)(F)F)C=CC=C32)S(=O)(=O)C2=CC=CC=C2[N+](=O)[O-])C=C1F.O.O=C([O-])[O-].[Na+] ",
"input": "",
"output": " CCOC(=O)CCC1=CC=C(N(C2CCC3=C(C4=C(C)C=C(O[Si](C)(C)C(C)(C)C)C=C4C)C=CC=C32)S(=O)(=O)C2=CC=CC=C2[N+](=O)[O-])C=C1F ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(O)C1=NC=CS1.O.O=C(O)CBr Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CC(O)C1SC=CN1CC(=O)O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC1(C)C(=O)NC2=CC(N)=C(N)C=C21.CC1=CC=C(S(=O)(=O)O)C=C1.CCO.O=CC1=CC=C(N2C=CN=C2)C=C1 , what product could potentially be produced?",
"input": "",
"output": "The product can be CC1(C)C(=O)NC2=CC3=C(C=C21)N=C(C1=CC=C(N2C=CN=C2)C=C1)N3 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC1=C(Cl)C=CC=C1N=C=S.CCOC(=O)CNC1=CC=CC=C1.ClC(Cl)Cl .",
"input": "",
"output": " CC1=C(Cl)C=CC=C1N1C(=O)CN(C2=CC=CC=C2)C1=S ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C1=CC=C(P(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.C1=CC=CC=C1.CC(C)(C)NS(=O)(=O)C1=CC=CC=C1B(O)O.CCCC[N+](CCCC)(CCCC)CCCC.ClCCl.NC1=CC=C(Br)C=C1.O.O=C([O-])[O-].[Br-].[Na+].[Pd] .",
"input": "",
"output": " CC(C)(C)NS(=O)(=O)C1=CC=CC=C1C1=CC=C(N)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C1CCNC1.C1CCOC1.CCN(CC)CC.COC1=CC=C(C(=O)OCC2=CC=C(C(=O)Cl)C=C2)C=C1C(C)(C)C.O as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: COC1=CC=C(C(=O)OCC2=CC=C(C(=O)NN3CCCC3)C=C2)C=C1C(C)(C)C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CCO.COC1=CC(CNC2=CC=C(N3CCCC3)C=C2NC(=O)C2=CC=CC=C2)=CC(OC)=C1OC.Cl.N.[OH-] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " COC1=CC(CN2C(C3=CC=CC=C3)=NC3=CC(N4CCCC4)=CC=C32)=CC(OC)=C1OC ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC1(CC2CCCC2)CC2=CC(O)=C(Cl)C(Cl)=C2C1=O.CN(C)C=O.O=C([O-])[O-].O=S(=O)(Cl)C(F)(F)F.[K+] ",
"input": "",
"output": " CC1(CC2CCCC2)CC2=CC(OS(=O)(=O)C(F)(F)F)=C(Cl)C(Cl)=C2C1=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CCC(C)C(=O)CC(=O)CC1=CC=CC(C(F)(F)F)=C1.CN.COC(OC)N(C)C.Cl ",
"input": "",
"output": " CCC(C)C(=O)C1=CN(C)C=C(C2=CC=CC(C(F)(F)F)=C2)C1=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses BrC(C1=CC=CC=C1)C1=CC=CC=C1.CN(C)C=O.Cl.N[C@@H](CC1=CC=C(F)C=C1)C(=O)O.O.O=C([O-])[O-].O=N[O-].[Ag+].[Cs+] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: O=C(OC(C1=CC=CC=C1)C1=CC=CC=C1)C(O)CC1=CC=C(F)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC1=C(COC2=CC=C(/C=C/C=O)C=C2)N=C(C2=CC=C3C=CC=CC3=C2)O1.CCOP(=O)(CC#N)OCC ",
"input": "",
"output": " CC1=C(COC2=CC=C(/C=C/C=C/C#N)C=C2)N=C(C2=CC=C3C=CC=CC3=C2)O1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CCCN.CN(C)C=O.O=C1C2=CC(Cl)=CC=C2N2C=NC(C3=NOC(CCl)=N3)=C2[C@@H]2CCN12 as the reactants and reagents.",
"input": "",
"output": " CCCNCC1=NC(C2=C3[C@@H]4CCN4C(=O)C4=CC(Cl)=CC=C4N3C=N2)=NO1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CN(C)C=O.CN1C(CO)=NC2=C(O)C3=C(N=C(CO)N(C)C3=O)C(O)=C2C1=O.CS(=O)(=O)Cl.O.[Br-].[Cl-].[K+].[Li+] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CN1C(CCl)=NC2=C(O)C3=C(N=C(CCl)N(C)C3=O)C(O)=C2C1=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC(C)Br.CC1=CC=CN=C1C(=O)CCC1=COC(C2=CC=C(O)C(OC(F)F)=C2)=N1 .",
"input": "",
"output": " CC1=CC=CN=C1C(=O)CCC1=COC(C2=CC=C(OC(C)C)C(OC(F)F)=C2)=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCO.NC1=CC=CC2=CC=CC=C12.O=[N+]([O-])C1=CC=[N+]([O-])C=C1F Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be O=[N+]([O-])C1=CC=NC=C1[NH+]([O-])C1=CC=CC2=CC=CC=C12 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. C1=CC=C(P(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.CCOC(=O)/N=N/C(=O)OCC.COC(=O)[C@H](CO)NS(=O)(=O)C1=CC=CC=C1 ",
"input": "",
"output": " COC(=O)C1C[N@@]1S(=O)(=O)C1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)(C)OC(=O)C=CC1=CC=C(O)C=C1C=O.CC(C)(C)[Si](Cl)(C1=CC=CC=C1)C1=CC=CC=C1.CCN(CC)CC.ClCCl Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CC(C)(C)OC(=O)C=CC1=CC=C(O[Si](C2=CC=CC=C2)(C2=CC=CC=C2)C(C)(C)C)C=C1C=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC1=CC=C(C(=O)O)N=C1OCC1CC1.O=C(N[C@@H](CC1CC1)C1=NC=CS1)C1=CC=C(C2CCOCC2)C(OCC2CC2)=N1 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CC1=CC=C(C(=O)N[C@@H](CC2CC2)C2=NC=CS2)N=C1OCC1CC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CN(C)C=O.CS(=O)(=O)OCC#CC1=CN=CC(Br)=C1.Cl.FC1(F)CCNC1.O.O=C([O-])[O-].[K+] , what product could potentially be produced?",
"input": "",
"output": "The product can be FC1(F)CCN(CC#CC2=CN=CC(Br)=C2)C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC(C)(C)OC(=O)N1CCOC2=CC=C3NC=C(Cl)C3=C2C1.CN(C)C=O.N#CC1=CC=CC(S(=O)(=O)Cl)=C1.O=C(O)C(F)(F)F.[H-].[Na+] ",
"input": "",
"output": " N#CC1=CC=CC(S(=O)(=O)N2C=C(Cl)C3=C4CNCCOC4=CC=C32)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CC1=CC=CC=C1O.CCOC(=O)CCC1=CC=C(OC2=CC(C)=CC(OC3=CC=C(C(F)(F)F)C=C3Br)=C2)C=C1C as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CC1=CC(OC2=CC=C(CCC(=O)O)C(C)=C2)=CC(OC2=CC=C(C(F)(F)F)C=C2OC2=CC=CC=C2C)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CNCCC(=O)OC(C)(C)C.N#CC1=CC=C(F)C(CBr)=C1 .",
"input": "",
"output": " CN(CCC(=O)OC(C)(C)C)CC1=CC(C#N)=CC=C1F ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1CCC2OC2C1.C1CCNCC1.Cl.O.O=C([O-])[O-].[K+] ",
"input": "",
"output": " OC1CCCCC1N1CCCCC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CN(C)C1=CC=CC(O)=C1.CN(C)C=O.ClCCCI.O.[Cl-].[H-].[Na+] ",
"input": "",
"output": " CN(C)C1=CC=CC(OCCCCl)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CO.COC(=O)CS.COC1=CC=CC=C1C(C#N)=COS(=O)(=O)C1=CC=CC=C1.O.[NaH] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: COC(=O)C1=C(N)C(C2=CC=CC=C2OC)=CS1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC(C)(C)O.CCN(CC)CC.CCOCC.COC1=CC2=C(C(=O)O)C=NC(C(=O)C3=CC=CC(OC(C)C)=C3)=C2C=C1OC.Cl.ClCCl.[N-]=[N+]=NP(=O)(C1=CC=CC=C1)C1=CC=CC=C1 , what product could potentially be produced?",
"input": "",
"output": "The product can be COC1=CC2=C(N)C=NC(C(=O)C3=CC=CC(OC(C)C)=C3)=C2C=C1OC .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1=CC=C(C2=C(C3=CC=CC=C3)NC=N2)C=C1.CN(C)C=O.ClCCBr.O.[H-].[Na+] ",
"input": "",
"output": " ClCCN1C=NC(C2=CC=CC=C2)=C1C1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC1=CC=CC=C1.CCCCCNCCCCC.O=C(Cl)Cl.[Na+].[OH-] ",
"input": "",
"output": " CCCCCN(CCCCC)C(=O)Cl ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C1=CC=C(P(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.C1CCOC1.CC(C)(O)C#N.CCOC(=O)N=NC(=O)OCC.OC/C=C/C1(C2=CC=C(F)C=C2)CCCCC1 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " N#CC/C=C/C1(C2=CC=C(F)C=C2)CCCCC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC(C)(C)OC(=O)N1CCN2C1=CC(Cl)=NC2=O.OCC1=CC=C(OC2=CC=C(Cl)C(C(F)(F)F)=C2)C=C1.[H-].[Na+] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CC(C)(C)OC(=O)N1CCN2C1=CC(OCC1=CC=C(OC3=CC=C(Cl)C(C(F)(F)F)=C3)C=C1)=NC2=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C=CCBr.CC(C)CN1C2=CC=CC=C2C2=CC(C3=CC=C4NC5=CC=C(C6=CC=C7C(=C6)C6=CC=CC=C6N7CC(C)C)C=C5C4=C3)=CC=C21.CS(C)=O.[Na+].[OH-] as the reactants and reagents.",
"input": "",
"output": " C=CCN1C2=CC=C(C3=CC=C4C(=C3)C3=CC=CC=C3N4CC(C)C)C=C2C2=CC(C3=CC=C4C(=C3)C3=CC=CC=C3N4CC(C)C)=CC=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCCCC1.O=C(O)C=CC1=CC=C(Cl)C=C1.SC1=CC=CC=C1 Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be O=C(O)CC(SC1=CC=CC=C1)C1=CC=C(Cl)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCOC1=CC(SC)=CC=C1C(=O)O.Cl.NC1=CN=CN=C1N.O=P(Cl)(Cl)Cl Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CCOC1=CC(SC)=CC=C1C1=NC2=NC=NC=C2N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC(Cl)Cl.CCC(=O)Cl.CCOCC.COC1=CC=C2CCN(C(=O)C(F)(F)F)CCC2=C1.COC1=CC=C2CCN(C(=O)OC(C)(C)C)CCC2=C1.Cl.[Al+3].[Cl-] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CCC(=O)C1=CC2=C(C=C1O)CCN(C(=O)C(F)(F)F)CC2 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CCCCCCCNCCC1=CC=C(OC(C)(C)C(=O)OCC)C=C1.COC1=CC=C(N=C=O)C(OC)=C1.ClCCl as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CCCCCCCN(CCC1=CC=C(OC(C)(C)C(=O)OCC)C=C1)C(=O)NC1=CC=C(OC)C=C1OC .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC1=CC(=O)N(CC2=CC=C(Cl)C=C2)C2=CC=C(Cl)C=C12.CCOC(=O)OCC.CO.Cl.[H-].[Na+] .",
"input": "",
"output": " CC(C(=O)O)C1=CC(=O)N(CC2=CC=C(Cl)C=C2)C2=CC=C(Cl)C=C12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) COC(=O)[C@H](CC1=CC=C(C2CC(=O)N(COCC[Si](C)(C)C)S2(=O)=O)C(Br)=C1)NC(=O)OCC1=CC=CC=C1.ClCCl.O=C(O)C(F)(F)F as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: COC(=O)[C@H](CC1=CC=C(C2CC(=O)NS2(=O)=O)C(Br)=C1)NC(=O)OCC1=CC=CC=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CN(C)C=O.COC(=O)CN(C)C(=O)C1=C(C(=O)OC)C=NN1CC1=CC=C(OC)C=C1.O.[Cl-].[H-].[NH4+].[Na+] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " COC(=O)C1=C(O)C2=C(C(=O)N1C)N(CC1=CC=C(OC)C=C1)N=C2 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1COCCO1.C=C(C)C.CCOCC.COC(=O)C1=CC=CC(C[C@H](N)C(=O)O)=C1.Cl.O=C([O-])O.O=S(=O)(O)O.[Na+] as the reactants and reagents.",
"input": "",
"output": " COC(=O)C1=CC=CC(C[C@H](N)C(=O)OC(C)(C)C)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1CCOC1.CC(C)(C)[Si](C)(C)Cl.CCN(C(C)C)C(C)C.COC(=O)C1=CC=C(C(=O)Cl)C=C1.NCNC1=CC=C(C(=O)O)C=C1 as the reactants and reagents.",
"input": "",
"output": " COC(=O)C1=CC=C(C(=O)NCC2=CC=C(C(=O)O)C=C2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CCN(CC)CC.COC1=CC=C(CCN)C=C1.ClC1=NC(Cl)=C2N=CN(C3CCCC3)C2=N1 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: COC1=CC=C(CCNC2=NC(Cl)=NC3=C2N=CN3C2CCCC2)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CCN(CC)CC.CCOC(=O)C1CCCC2=C1C1=C(OC)C=CC(Cl)=C1N2CCF.CO.[Pd] ",
"input": "",
"output": " CCOC(=O)C1CCCC2=C1C1=C(OC)C=CC=C1N2CCF ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using BrCCCC1=CC=CC=C1.O=C(N[C@H]1CCNC1)C12CC3CC(CC(C3)C1)C2 as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " O=C(N[C@H]1CCN(CCCC2=CC=CC=C2)C1)C12CC3CC(CC(C3)C1)C2 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CC1=C(N2CCNCC2)N=C2C=C(F)C=C(F)C2=C1NC1=CN=CC(N2CCOCC2)=C1.O=C(O)C1=NC=CC=N1 as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CC1=C(N2CCN(C(=O)C3=NC=CC=N3)CC2)N=C2C=C(F)C=C(F)C2=C1NC1=CN=CC(N2CCOCC2)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1COCCOCCOCCN1.O=C(Cl)CC12CC3CC(CC(C3)C1)C2 Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be O=C(CC12CC3CC(CC(C3)C1)C2)N1CCOCCOCCOCC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CN(C)C=O.NCCNCC1=CC=CC=C1.O=CC(=O)C(F)(F)F.[BH3-]C#N.[Na+].[OH-] ",
"input": "",
"output": " FC(F)(F)C1CN(CC2=CC=CC=C2)CCN1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC1=CC(Cl)=CC(C)=C1N.COC1=CC=C2C(=C1)CCN1C2=CC(Cl)=NC1=O ",
"input": "",
"output": " COC1=CC=C2C(=C1)CCN1C2=CC(NC2=C(C)C=C(Cl)C=C2C)=NC1=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CCCC[Sn](CCCC)(CCCC)C1=NC(N2CCOCC2)=C2N=C(CN3CCC(C(C)(C)C)CC3)N(C)C2=N1.NC1=NC=C(Br)C2=CC=CC=C12 ",
"input": "",
"output": " CN1C(CN2CCC(C(C)(C)C)CC2)=NC2=C(N3CCOCC3)N=C(C3=CN=C(N)C4=CC=CC=C34)N=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CO.COC(=O)C1=CC=CC([N+](=O)[O-])=C1C(=O)OC.[Pd] ",
"input": "",
"output": " COC(=O)C1=CC=CC(N)=C1C(=O)OC ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.CC#N.CC(C)NC(C)C.O=CC1=CSC2=CC=CC=C12.[Cl-].[Li]CCCC.[NH4+] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be N#CCC(O)C1=CSC2=CC=CC=C12 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC1=CC=CC=C1C1=CC=C(C(=O)O)C=C1.CON=C1C[C@@H](C(=O)O)N(C(=O)OC(C)(C)C)C1.NCC(O)C1=CC=CC(O)=C1 Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CON=C1C[C@@H](C(=O)NCC(O)C2=CC=CC(O)=C2)N(C(=O)C2=CC=C(C3=CC=CC=C3C)C=C2)C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) COC1=CC(C(=O)Cl)=CC(OC)=C1OC.O=C1NCN(C2=CC=CC=C2)C12CCNCC2 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: COC1=CC(C(=O)N2CCC3(CC2)C(=O)NCN3C2=CC=CC=C2)=CC(OC)=C1OC .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CCOC(OCC)OCC.CCOCC.FB(F)F.N=C(NO)C1=CC=C(OCCCOC2=C(Cl)C=C(OCC=C(Cl)Cl)C=C2Cl)C=C1 as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " ClC(Cl)=CCOC1=CC(Cl)=C(OCCCOC2=CC=C(C3=NOC=N3)C=C2)C(Cl)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C1=CC=NC=C1.Cl.ClCCl.O=C(Cl)CCl.O=C1CC(=O)C2CCC1C2 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: O=C(CCl)OC1=CC(=O)C2CCC1C2 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC#N.COC(=O)C1(COS(=O)(=O)C2=CC=C(C)C=C2)CN(C(=O)OC(C)(C)C)CCO1.COC1=CC=C(CN)C(OC)=C1 Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " COC(=O)C1(CNCC2=CC=C(OC)C=C2OC)CN(C(=O)OC(C)(C)C)CCO1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C1CCOC1.CC1=CC=CC=C1.CCOC(C)=O.COC1=CC=C(C(=O)C2C(=O)CCC3=CC(OC)=CC=C32)C=C1.COC1=CC=CC([Mg]Br)=C1.O=P(Cl)(OC1=CC=CC=C1)OC1=CC=CC=C1.[Cl-].[H-].[H][H].[NH4+].[Na+] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " COC1=CC=C(C(=O)C2=C(C3=CC=CC(OC)=C3)CCC3=CC(OC)=CC=C23)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C1=CC=C(P(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.C1CCOC1.CC(C)(C)[Si](OCC/C(N)=N/O)(C1=CC=CC=C1)C1=CC=CC=C1.CC1=NC(Cl)=CC=C1C(=O)O.CCN(C(C)C)C(C)C.N#CC(Cl)(Cl)Cl is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC1=NC(Cl)=CC=C1C1=NC(CCO[Si](C2=CC=CC=C2)(C2=CC=CC=C2)C(C)(C)C)=NO1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC1=CC(N)=CC=C1Br.OB(O)C1=C(Cl)C=CC=C1Cl.OB(O)C1=CC=C(Cl)C=C1 ",
"input": "",
"output": " NC1=CC=C(C2=C(Cl)C=CC=C2Cl)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C(=NC1CCCCC1)=NC1CCCCC1.CCOC(C)=O.CSCC[C@H](NC=O)C(=O)O.C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CS Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CSCCC(NC=O)C(=O)SCC(=O)[C@@]1(O)[C@@H](C)C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@@]21C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC[N+](=C=N)CCCN(C)C.ClCCl.NC1CC[C@H]2CN(CC3=CC=CC=C3)C[C@@H]12.O=C(O)C(C1CCCCC1)C1CCCCC1.ON1N=NC2=CC=CC=C21 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: O=C(N[C@H]1CC[C@H]2CN(CC3=CC=CC=C3)C[C@H]21)C(C1CCCCC1)C1CCCCC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC(C)=O.CCO.CCOC(=O)[C@@H]1CCCN(CCOC2=CC=CC=C2)C1.Cl.O.[Na+].[OH-] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " O=C(O)[C@@H]1CCCN(CCOC2=CC=CC=C2)C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C=O.CN(N)C(=O)NC1=NN=C(C2CCCCC2)S1.CO.[K+].[OH-] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CN1NCN(C2=NN=C(C3CCCCC3)S2)C1=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC1=CC(C)=C(N)C(N)=C1.O.O=C([O-])O.O=CO.[Na+] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CC1=CC(C)=C2N=CNC2=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC(C)(C)OC(=O)N(CC1=NC=CO1)C1=CN=CC=C1I.CCCCCCC.CCOC(C)=O.COC1=CC(F)=CC=C1B(O)O , what product could potentially be produced?",
"input": "",
"output": "The product can be COC1=CC(F)=CC=C1C1=CC=NC=C1N(CC1=NC=CO1)C(=O)OC(C)(C)C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCC1=CN=C(N2CCN(C(=O)C3=CN=C(F)C=C3C)CC2)C(C)=C1.COC1=CC=C(CN)C=C1.O Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CCC1=CN=C(N2CCN(C(=O)C3=CN=C(NCC4=CC=C(OC)C=C4)C=C3C)CC2)C(C)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C1=CC=C(C2=CC=CC=C2)C=C1.C1=CC=C(OC2=CC=CC=C2)C=C1.CCOC(=O)C(=CNC1=CC=C(Cl)N=C1)S(C)(=O)=O is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CS(=O)(=O)C1=CN=C2C=CC(Cl)=NC2=C1O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC1=CC(C2=NOC(C(F)(F)F)=N2)=CC(C)=C1OCCCC1=CNC(=O)C=C1.CI.CN(C)C=O.COCCOCCN(CCOCCOC)CCOCCOC.O=C([O-])[O-].[K+] , what product could potentially be produced?",
"input": "",
"output": "The product can be CC1=CC(C2=NOC(C(F)(F)F)=N2)=CC(C)=C1OCCCC1=CC=CN(C)C1=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CC=CC=C1.CC1=NN(C2CCCC2)C(N)=C1.CCOC(=O)C(=O)CC(=O)C1CC1 Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CCOC(=O)C1=CC(C2CC2)=NC2=C1C(C)=NN2C1CCCC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC1=CC=CC=C1C.CCOC(=O)C(=CC1=CC=C(C2=CC=CC=C2)S1)N=[N+]=[N-] ",
"input": "",
"output": " CCOC(=O)C1=CC2=C(C=C(C3=CC=CC=C3)S2)N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CN(C)[C@@H]1CCNC1.COC1=CC(F)=C([N+](=O)[O-])C=C1NC1=NC=C(Cl)C(C2=CN(C)C3=CC=CC=C23)=N1.COC1=CC(F)=C([N+](=O)[O-])C=C1NC1=NC=CC(C2=CN(C)C3=CC=CC=C23)=N1.OCC(F)(F)F as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: COC1=CC(N2CC[C@@H](N(C)C)C2)=C([N+](=O)[O-])C=C1NC1=NC=CC(C2=CN(C)C3=CC=CC=C23)=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)C(=O)CC(C(=O)C1=CC=C(F)C=C1)C1=CC=CC=C1.CC1(C)O[C@H](CCN)C[C@H](CC(=O)N2CCCCC2)O1 Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CC(C)C1=CC(C2=CC=CC=C2)=C(C2=CC=C(F)C=C2)N1CC[C@@H]1C[C@H](CC(=O)N2CCCCC2)OC(C)(C)O1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CN(C)C=O.CN1CCOCC1.CNO.COC1=NC(Cl)=NC(OC)=N1.Cl.O=C(O)C1=CC2=C(C=N1)N(CC1=CC=C(F)C=C1)C=C2COCCN1CCCC1=O Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CN(O)C(=O)C1=CC2=C(C=N1)N(CC1=CC=C(F)C=C1)C=C2COCCN1CCCC1=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCNCC1.CC(C)OC(C)C.CN(C)C=O.O=C(OC1=CC=CC=C1)OC1C2=NC=CN=C2C(=O)N1C1=CC=C2C=CC(Cl)=NC2=N1 Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be O=C(OC1C2=NC=CN=C2C(=O)N1C1=CC=C2C=CC(Cl)=NC2=N1)N1CCCCC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C1CCOC1.C1COCCO1.CCOC(C)=O.NC1=CC=CNC1=O.O=C(Cl)OCC1=CC=CC=C1.O=C([O-])[O-].[Na+] .",
"input": "",
"output": " O=C(NC1=CC=CNC1=O)OCC1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CCO.COC1=CC(C2=NC(Cl)=C(C(F)(F)F)C=C2Cl)=CC=C1Cl.[K+].[OH-] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CCOC1=NC(C2=CC=C(Cl)C(OC)=C2)=C(Cl)C=C1C(F)(F)F ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1COCCN1.CC(C)(C)[O-].CC(C)C1=CC(C(C)C)=C(C2=CC=CC=C2P(C2CCCCC2)C2CCCCC2)C(C(C)C)=C1.CC1=C(C2=CC=CC=N2)N=C2C=C(F)C=CC2=C1OC1=CC(Br)=CC=C1C#N.CC1=CC=CC=C1.O=C(/C=C/C1=CC=CC=C1)/C=C/C1=CC=CC=C1.[Na+].[Pd] ",
"input": "",
"output": " CC1=C(C2=CC=CC=N2)N=C2C=C(F)C=CC2=C1OC1=CC(N2CCOCC2)=CC=C1C#N ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. BrCCC1=CC=CC=C1.CC#N.COC1=CC=CC(C2CCCN2)=C1.O=C([O-])[O-].[K+] ",
"input": "",
"output": " COC1=CC=CC(C2CCCN2CCC2=CC=CC=C2)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C1CCOC1.COC(=O)C1=CC(OCC2=CC=C(OCC3=C(C)OC(C4=CC=CC=C4)=N3)C(OC)=C2)=NN1C1=CC=CC=C1.O.O=S(=O)([O-])[O-].[Al+3].[H-].[Li+].[Na+] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " COC1=CC(COC2=NN(C3=CC=CC=C3)C(CO)=C2)=CC=C1OCC1=C(C)OC(C2=CC=CC=C2)=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CCOC(=O)CC1=CC=CC(COC2=CC=C(I)C=C2)=C1.COC1=NC=CC=C1B(O)O as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: COC1=NC=CC=C1C1=CC=C(OCC2=CC=CC(CC(=O)O)=C2)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C1CCOC1.COC1(OC)CCC(COS(=O)(=O)C2=CC=C(C)C=C2)(COS(=O)(=O)C2=CC=C(C)C=C2)CC1.Cl as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CC1=CC=C(S(=O)(=O)OCC2(COS(=O)(=O)C3=CC=C(C)C=C3)CCC(=O)CC2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC1=CC(N)=NC(C)=C1C#N.O.O=N[O-].O=S(=O)(O)O.[Na+] , what product could potentially be produced?",
"input": "",
"output": "The product can be CC1=CC(O)=NC(C)=C1C#N .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C1=CC=NC=C1.CC1=CC=CC=C1.CCCC(=O)Cl.CCCCCCCCCCOC1=CN=C(C2=CC=C(C=CC(C)O)C=C2)N=C1 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CCCCCCCCCCOC1=CN=C(C2=CC=C(C=CC(C)OC(=O)CCC)C=C2)N=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC(C)C1=CC=CC=C1CCC(=O)O.CC1=CC=CC=C1.O=S(Cl)Cl ",
"input": "",
"output": " CC(C)C1=CC=CC=C1CCC(=O)Cl ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(=O)O.CO.COC1=CC(CC(=O)NC2=CC=CC(/C=C/C3=CC=CC(C)=C3)=C2)=CC=C1OCCNC(=O)OC(C)(C)C.[Pd] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be COC1=CC(CC(=O)NC2=CC=CC(CCC3=CC=CC(C)=C3)=C2)=CC=C1OCCNC(=O)OC(C)(C)C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CCOC1=CC(C=O)=CC=C1OCC1=CC=CC=C1.CO.Cl.O=C1COC2=CC(O)=CC=C12 ",
"input": "",
"output": " CCOC1=CC(C=C2OC3=CC(O)=CC=C3C2=O)=CC=C1OCC1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. BrC1=CC=C(NC2=NC=CC=N2)C=C1.CCN(CC)CC.CN(C)C=O.Cl.ClCC1=CC=CN=C1.O.[Cl-].[H-].[Na+] ",
"input": "",
"output": " BrC1=CC=C(N(CC2=CC=CN=C2)C2=NC=CC=N2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1=CC=CC=C1.CC(C)(C)C(=O)OCBr.CN(C)P(=O)(N(C)C)N(C)C.O=C([O-])C1C(=O)CC2CC(=O)N21.[Na+] ",
"input": "",
"output": " CC(C)(C)C(=O)OCOC(=O)C1C(=O)CC2CC(=O)N21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC1=CC=CC=C1.CCN(CC)CC.CO.O=C1NC=NC2=CC=C(I)C=C12.O=P(Cl)(Cl)Cl ",
"input": "",
"output": " COC1=NC=NC2=CC=C(I)C=C12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CC(C)(C)N=C=O.CCN1C=C(C2=CC=NC3=C2C=CN3)C(C2=CC=C(N)C=C2)=N1 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CCN1C=C(C2=CC=NC3=C2C=CN3)C(C2=CC=C(NC(=O)NC(C)(C)C)C=C2)=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CCN(CC)CC.CN(C)CCN.CS(=O)(=O)Cl.ClCCl ",
"input": "",
"output": " CN(C)CCNS(C)(=O)=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C1CCOC1.CCI.CCOC(C)=O.COC(=O)NC1=C(N)N=C(N2N=C(CC3=CC=CC=C3F)C3=NC=C(F)C=C32)N=C1N.C[Si](C)(C)[N-][Si](C)(C)C.[Na+] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " COC(=O)NCCC1=C(N)N=C(N2N=C(CC3=CC=CC=C3F)C3=NC=C(F)C=C32)N=C1N ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CCN(CC)CC.CCOC(=O)C(O)CC(C)(C)C1=CC=CC(OC)=C1.CS(C)=O.ClCCl as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CCOC(=O)C(=O)CC(C)(C)C1=CC=CC(OC)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC#N.COC(=O)C1=CC=C(Br)C=C1CBr.O=C([O-])[O-].O=C1NN=C(C2=CC=C(Cl)C=C2)N1CC(O)C(F)(F)F.[Cs+] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " COC(=O)C1=CC=C(Br)C=C1CN1N=C(C2=CC=C(Cl)C=C2)N(CC(O)C(F)(F)F)C1=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CCCC(C)C.CN(C)C(OC(C)(C)C)N(C)C.COC(C)(C)C.COC1=CC=C(C(C)=O)C=C1COC(=O)C(C)(C)C.O as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: COC1=CC=C(C(=O)/C=C/N(C)C)C=C1COC(=O)C(C)(C)C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CC=C(P(C2=CC=CC=C2)[C-]2C=CC=C2)C=C1.C1COCCO1.CC(=O)[O-].CC(C)(C)OC(=O)N1CCC[C@H]1C1=NC=C(Br)N1.CC(C)C(NC(=O)[O-])C(=O)N1CCC[C@H]1C1=NC2=CC=C(C3=CC=C4C(=C3)CCC3=CC(Br)=CC=C34)C=C2N1.CC1(C)OB(B2OC(C)(C)C(C)(C)O2)OC1(C)C.COCCOC.Cl[Pd]Cl.O=P([O-])([O-])[O-].[Fe+2].[K+] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be COC(=O)N[C@H](C(=O)N1CCC[C@H]1C1=NC2=CC=C(C3=CC=C4C(=C3)CCC3=CC(C5=CN=C([C@@H]6CCCN6C(=O)OC(C)(C)C)N5)=CC=C34)C=C2N1)C(C)C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CN(C)C=O.NC(=O)CI.OC(C1=CC=C2C(=C1)C=NN2C1=CC=CN=C1)(C1=CNC2=CC=CC=C12)C(F)(F)F.[K+].[OH-] ",
"input": "",
"output": " NC(=O)CN1C=C(C(O)(C2=CC=C3C(=C2)C=NN3C2=CC=CN=C2)C(F)(F)F)C2=CC=CC=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C=CC(=O)NCCCCOC(=O)C(OCCCCNC(=O)C=C)C1=CC=CC=C1.C=CC(=O)NCCCCOC(=O)CC1=CC=C(OCCCCNC(=O)C=C)C=C1.C=CC(=O)NCCCCOC(=O)CC1=CC=CC(OCCCCNC(=O)C=C)=C1.C=CC(=O)NCCCCOC(=O)CC1=CC=CC=C1OCCCCNC(=O)C=C .",
"input": "",
"output": " C=CC(=O)NCCCCOC1=CC=C(C(=O)OCC2=CC=CC=C2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.CC(C)C1=CC=C(C(=O)C2CCN(CC3=CC=CC=C3)CC2)C=C1.CCCCCC.COC1=C(C)C(C)=CC(C)=C1Br.O.[Li]CCCC Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be COC1=C(C)C(C)=CC(C)=C1C(O)(C1=CC=C(C(C)C)C=C1)C1CCN(CC2=CC=CC=C2)CC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC1(C)CC(=O)NC2=CC(N)=C(N)C=C21.Cl.O=C(Cl)Cl Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CC1(C)CC(=O)NC2=CC3=C(C=C21)NC(O)=N3 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C#C[Mg]Br.CCN(CC(C)C)C1=CC=C(C=O)C=C1C(C)(C)C as the reactants and reagents.",
"input": "",
"output": " C#CC(O)C1=CC=C(N(CC)CC(C)C)C(C(C)(C)C)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CC(C)OC(=O)N1CCC(COC2=CC=C(Br)C=C2)CC1.CC(C)SC1=CC=C(B(O)O)C=C1 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CC(C)OC(=O)N1CCC(COC2=CC=C(C3=CC=C(SC(C)C)C=C3)C=C2)CC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. C1=CC=NC=C1.CC(=O)N1CCCC1C1=CC2=C(C=C1OC1=CC=C(N)N=C1)N=C(C1=CC=CC=N1)N2.CC(=O)OC(C)=O ",
"input": "",
"output": " CC(=O)NC1=CC=C(OC2=CC3=C(C=C2C2CCCN2C(C)=O)NC(C2=CC=CC=N2)=N3)C=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. C1COCCO1.CC(C)(C)[Si](C)(C)OC1CCNCC1.COC(=O)C1=CC(C)=C(NC(=O)C2=CC(Br)=CC=C2C(F)(F)F)C(C)=C1.COC1=CC=CC(OC)=C1C1=CC=CC=C1P(C1CCCCC1)C1CCCCC1.O=C(/C=C/C1=CC=CC=C1)/C=C/C1=CC=CC=C1.O=C([O-])[O-].[Cs+].[Pd] ",
"input": "",
"output": " COC(=O)C1=CC(C)=C(NC(=O)C2=CC(N3CCC(O[Si](C)(C)C(C)(C)C)CC3)=CC=C2C(F)(F)F)C(C)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC(C)C[AlH]CC(C)C.CC1=CC=CC=C1.CCOC(=O)CCCC1=CC(F)=CC=C1OC.CO.Cl as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: COC1=CC=C(F)C=C1CCCC=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CO.O.O=C(O)C1=CC=C(O)C=C1C(F)(F)F.O=S(=O)(O)O as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " COC(=O)C1=CC=C(O)C=C1C(F)(F)F ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.CCC(=O)CC(=O)CC.CCOC(=O)CBr.[Cl-].[H-].[NH4+].[Na+] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CCOC(=O)CC(C(=O)CC)C(=O)CC ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C.C1CCOC1.CCO.CCOC(=O)C=C1CCCCN(CC2=CC=CC=C2)C1.CCOC(=O)CP(=O)(OCC)OCC.CCOC(C)=O.Cl.O=C1CCCCN(CC2=CC=CC=C2)C1.[H-].[H][H].[Na+].[Pd] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CCOC(=O)CC1CCCCNC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C=CC1=CC=C2C=C(OC)C=C([N+](=O)[O-])C2=N1.CC1=CC=CC=C1.NN.O.[Ni] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CCC1=CC=C2C=C(OC)C=C(N)C2=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C1=CC=CC=C1.CC1=CC=C(Cl)C=C1OCC(O)CO.CC1=CC=C(S(=O)(=O)O)C=C1.O=C(CBr)C1=CC=C(Cl)C=C1 as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CC1=CC=C(Cl)C=C1OCC1COC(CBr)(C2=CC=C(Cl)C=C2)O1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC1=C(CO)C(C2=CC=C(F)C=N2)=NO1.ClCCl.O=C([O-])O.[Na+] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC1=C(C=O)C(C2=CC=C(F)C=N2)=NO1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC(=O)C1=CC=C(N)C=C1O.CN1CCN(C)C1=O.ClC1=NN=C(CC2=CC=NC=C2)C2=CC=CC=C12.ClCCl.N , what product could potentially be produced?",
"input": "",
"output": "The product can be CC(=O)C1=CC=C(NC2=NN=C(CC3=CC=NC=C3)C3=CC=CC=C23)C=C1O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " BrCCCCCCBr.O.O=S(=O)(O)O.OCCCC1=CC=CC=C1.[Na+].[OH-] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be BrCCCCCCOCCCC1=CC=CC=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C1COCCO1.CNC1CCC2=CC=CC=C2C(O)(C2=CC=CC=C2)C1.O.O=S(=O)(O)O is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CNC1C=C(C2=CC=CC=C2)C2=CC=CC=C2CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCO.COC1=CC=CC(CN)=C1.FC(F)(F)C1=CC(Cl)=NC(C2=CC=CN=C2)=N1 Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " COC1=CC=CC(CNC2=CC(C(F)(F)F)=NC(C3=CC=CN=C3)=N2)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CC#N.CC1CCNCC1.CCOC(=O)C(Br)C1=CC=CC=C1 as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CCOC(=O)C(C1=CC=CC=C1)N1CCC(C)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C#CC1=CC=C2C(=O)C(Br)CC2=C1.NC(=S)C1=CC=CC=C1 , what product could potentially be produced?",
"input": "",
"output": "The product can be Br.C#CC1=CC=C2C(=C1)CC1SC(C3=CC=CC=C3)=NC21O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. Br.CC(=O)O.COC1=CC=C(N(CC2=CC=C(C)C=C2)CC2=CC=C(C)C=C2)C=C1NC(=S)NC(=O)C1=CC=CC=C1.CS(C)=O ",
"input": "",
"output": " COC1=CC=C(N(CC2=CC=C(C)C=C2)CC2=CC=C(C)C=C2)C2=C1N=C(NC(=O)C1=CC=CC=C1)S2 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CCN1C=CC(CN2C(=O)N(C3CCNCC3)C(=O)C3=C2C=C(C2=CC=CC=C2)S3)=N1.CCN=C=NCCCN(C)C.CCOC1=CC2=C(C=C1OC)C(C1=CC=C(C(=O)O)C=C1)=N[C@@H]1CCSC[C@H]21.ClCCl.O.O=C(O)C(F)(F)F.O=S(=O)([O-])O.ON1N=NC2=CC=CC=C21.[K+] as the reactants and reagents.",
"input": "",
"output": " CCOC1=CC2=C(C=C1OC)C(C1=CC=C(C(=O)N3CCC(N4C(=O)C5=C(C=C(C6=CC=CC=C6)S5)N(CC5=NN(CC)C=C5)C4=O)CC3)C=C1)=N[C@@H]1CCSC[C@H]21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CO.COC1=CC=C([C@H]2CCC[C@H]3C=CCC(=O)N32)C=C1.O=[Pt].[H][H] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " COC1=CC=C([C@H]2CCC[C@H]3CCCC(=O)N32)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1CCOC1.O=C(OC(=O)C(F)(F)F)C(F)(F)F.O=S1CCSC1 ",
"input": "",
"output": " O=C([O-])C(F)(F)F.[CH+]1SCCS1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC1=CC(C(=O)O)=C(C=O)N1.C[C@@H]1CNC[C@H](C)N1 .",
"input": "",
"output": " CC1=CC(C(=O)N2C[C@@H](C)N[C@@H](C)C2)=C(C=O)N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCOCCO.NC1=CC=CC=C1.O.O=C(O)C1=CC=C(F)C=C1Br.O=C([O-])[O-].[Cu].[Cu]I.[K+] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " O=C(O)C1=CC=C(F)C=C1NC1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CN(C)C=O.O=C1CCO1.OC1=CC=CC(/C=C/C2=NC3=CC=CC=C3S2)=C1.[H-].[Na+] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " O=C(O)CCOC1=CC=CC(/C=C/C2=NC3=CC=CC=C3S2)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC1=CC=CC=N1.CN(C)C=O.Cl.ClC(Cl)Cl.O=C1N(Cl)C(=O)N(Cl)C(=O)N1Cl as the reactants and reagents.",
"input": "",
"output": " ClCC1=CC=CC=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C1CCOC1.CC#N.CCN(CC)CC.CS(=O)(=O)Cl.CS(=O)(=O)OCCCCC1=CNC2=CC=C(F)C=C12.Cl.O=C(O)CCCC1=CNC2=CC=C(F)C=C12.O=C1C=CC2=CC(N3CCNCC3)=CC=C2O1.OCCCCC1=CNC2=CC=C(F)C=C12.[Al+3].[H-].[Li+] , what product could potentially be produced?",
"input": "",
"output": "The product can be O=C1C=CC2=CC(N3CCN(CCCCC4=CNC5=CC=C(F)C=C45)CC3)=CC=C2O1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CCCCCCCCCCCC(=O)O[C@H](C)C(CCC)C(=O)OC(C)(C)C.CO.O.O=S(=O)(O)O ",
"input": "",
"output": " CCCC(C(=O)OC)[C@@H](C)O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C(=NC1CCCCC1)=NC1CCCCC1.C1=CC=NC=C1.CC(N)C(=O)NC1=CC(CO)=CC(NC2=C3C=CC=CC3=NC3=CC=CC=C23)=C1.CCC1=NC(OC)=C(NC(=O)N2CCN(C3=CC=CC=C3)CC2)C=C1C(=O)O.CN(C)C1=CC=NC=C1 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: COC1=NC(C)=C(C(=O)NC(C)C(=O)NC2=CC(CO)=CC(NC3=C4C=CC=CC4=NC4=CC=CC=C34)=C2)C=C1NC(=O)N1CCN(C2=CC=CC=C2)CC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CCN=C=NCCCN(C)C.CN(C)C1=CC=C(C(=O)O)C=C1.CN(C)C=O.COC1=CC2=NC=CC(OC3=CC=C(N)C=C3)=C2C=C1OC.Cl ",
"input": "",
"output": " COC1=CC2=NC=CC(OC3=CC=C(NC(=O)C4=CC=CC=C4N(C)C)C=C3)=C2C=C1OC ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC(C)(O)[C@@H]1CCNC1.CCN(C(C)C)C(C)C.C[C@@H]1CCC[C@](O)(CNC(=O)C2=C(Cl)C=CC3=NC(Cl)=CC=C23)C1 , what product could potentially be produced?",
"input": "",
"output": "The product can be C[C@@H]1CCC[C@](O)(CNC(=O)C2=C(Cl)C=CC3=NC(N4CC[C@@H](C(C)(C)O)C4)=CC=C23)C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC(C)(O)[C@H]1CCNC1.CCN(C(C)C)C(C)C.C[C@@H]1CCC[C@](O)(CNC(=O)C2=C(Cl)C=CC3=NC(Cl)=CC=C23)C1 as the reactants and reagents.",
"input": "",
"output": " C[C@@H]1CCC[C@](O)(CNC(=O)C2=C(Cl)C=CC3=NC(N4CC[C@H](C(C)(C)O)C4)=CC=C23)C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1=CC=C(P(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.C1CCOC1.CCOC(=O)/N=N/C(=O)OCC.CN1CCC(O)C1.OC1=CC=CN=C1 as the reactants and reagents.",
"input": "",
"output": " CN1CCC(OC2=CC=CN=C2)C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: BrC1=NC=NC2=C1N=CN2.CC(C)O.CC(N)C1=CC(Cl)=C(CC#N)C(C#N)=C1C1=CC=CC(F)=C1.CCN(C(C)C)C(C)C , what product could potentially be produced?",
"input": "",
"output": "The product can be CC(NC1=NC=NC2=C1N=CN2)C1=CC(Cl)=C(CC#N)C(C#N)=C1C1=CC=CC(F)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C1CCOC1.CC#N.COC(=O)C1=CC=NC(OC)=C1.[Li]CCCC as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " COC1=CC(C(=O)CC#N)=CC=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CCO.N.O.O=C1OCC2=C1C=CC([N+](=O)[O-])=C2Br.O=S(=O)([O-])[O-].[Fe+2] as the reactants and reagents.",
"input": "",
"output": " NC1=CC=C2C(=O)OCC2=C1Br ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C1=CC=NC=C1.C1CCOC1.CC#N.COC1=CC=C(CNC2=C(N)C(Cl)=NC3=CC=CC=C23)C=C1.O=C(N1C=CN=C1)N1C=CN=C1 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: COC1=CC=C(CN2C(O)=NC3=C(Cl)N=C4C=CC=CC4=C32)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. BrC1=CN2N=CC(C3=CC=CC=C3)=C2N=C1.C1=CC=C(P(C2=CC=CC=C2)[C-]2C=CC=C2)C=C1.C1=CC=C([PH](C2=CC=CC=C2)(C2=CC=CC=C2)[Pd]([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)[PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.C1COCCO1.CC(=O)[O-].CC1(C)OB(B2OC(C)(C)C(C)(C)O2)OC1(C)C.CN(C)C=O.COC(=O)C1=CC(B2OC(C)(C)C(C)(C)O2)=CS1.Cl[Pd]Cl.O=C([O-])[O-].[Fe+2].[K+].[Na+] ",
"input": "",
"output": " COC(=O)C1=CC(C2=CN3N=CC(C4=CC=CC=C4)=C3N=C2)=CS1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C=C(C)C(=O)OC1C(C)(C)C(O)C1(C)C.C=C1CC(=O)O1.CN(C)C1=CC=NC=C1.ClCCl ",
"input": "",
"output": " C=C(C)C(=O)OC1C(C)(C)C(OC(=O)CC(C)=O)C1(C)C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC(C)(C)C(=O)O.NNC(N)=S.O=S(=O)(O)O.[NH4+].[OH-] ",
"input": "",
"output": " CC(C)(C)C1=NN=C(N)S1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C1=CC=C(P(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.C1CCOC1.CC(C)OC(=O)/N=N/C(=O)OC(C)C.COC(=O)C1=CNC=N1.O=C(C1=CC=CC=C1)N1CCC(O)C2=CC=CC=C21 .",
"input": "",
"output": " COC(=O)C1=CN=CN1C1CCN(C(=O)C2=CC=CC=C2)C2=CC=CC=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: NC1=CC=C(O)C=C1F.O=C(Cl)CCCCCBr .",
"input": "",
"output": " O=C(CCCCCBr)NC1=CC=C(O)C=C1F ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CC(C)(C)C1=NC(N2CCC(F)(F)C2)=C2N=NNC2=N1.CCN1N=C2N=C(C(C)(C)C)N=C(N3CCC(F)(F)C3)C2=N1.ClCC1=NC(Cl)=CC=C1Cl as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CC(C)(C)C1=NC2=NN(CC3=NC(Cl)=CC=C3Cl)N=C2C(N2CCC(F)(F)C2)=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)(C)OC(=O)N1CC[C@H](C2=CC=C(OCCCOCC3CC3)C=C2)[C@@H](OCC2=CC=C3CCCN(CCCO)C3=C2)C1.CS(=O)(=O)Cl Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CC(C)(C)OC(=O)N1CC[C@H](C2=CC=C(OCCCOCC3CC3)C=C2)[C@@H](OCC2=CC=C3CCCN(CCCOS(C)(=O)=O)C3=C2)C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1COCCO1.CB(O)O.CC(=O)[O-].CC(C)(C)P([C-]1C=CC=C1)C(C)(C)C.CCOC(=O)C1=C(C)N(C2=CC=C(Br)C=N2)N=C1.O=P([O-])([O-])[O-].[Cl-].[Fe+2].[K+].[NH4+].[Pd+2] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CCOC(=O)C1=C(C)N(C2=CC=C(C)C=N2)N=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C1=CC=NC=C1.ClCCl.N#CC(C1=CC=CC=C1)(C1=CC=CC=C1)C1CCN(CC2=CC=CC=C2)C1.O=C(Cl)OC1=CC=CC=C1 .",
"input": "",
"output": " N#CC(C1=CC=CC=C1)(C1=CC=CC=C1)C1CCN(C(=O)OC2=CC=CC=C2)C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CO.COC(CC(=O)C1=CC=C(C)C=C1)C(=O)O.NN.O ",
"input": "",
"output": " COC1CC(C2=CC=C(C)C=C2)=NNC1=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1CCOC1.CC1=CC(C(C)(C)C)=CC1.CC1=CC=C(C(=O)C2=CC=C(C)C=C2)C=C1.CCCCCC.CN1CCN(C)C1=O.CO.Cl.O=C=O.[Li]CCCC ",
"input": "",
"output": " CC1=CC(C(C)(C)C)=CC1=C(C1=CC=C(C)C=C1)C1=CC=C(C)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. C1=CC=NC=C1.CC(C)(C)OC(=O)N1C[C@H](OCC2CCCCC2)OC[C@@H]1[C@@H](O)[C@@H](N)CC1=CC(F)=CC(F)=C1.CCCCCCN(C)C(=O)Cl.ClCCl ",
"input": "",
"output": " CCCCCCN(C)C(=O)N[C@@H](CC1=CC(F)=CC(F)=C1)[C@H](O)[C@H]1CO[C@@H](OCC2CCCCC2)CN1.Cl ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC(=O)[O-].CCO.COC1=CC=C(C(=O)C2=CC(CCC(=O)O)=C(OC)C=C2OC)C=C1.Cl.NO.[Na+] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: COC1=CC=C(C(=NO)C2=CC(CCC(=O)O)=C(OC)C=C2OC)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC1(C)CC(C2=CC=CC=C2[N+](=O)[O-])NC2=CC=C(Cl)C=C21.CCO.Cl.[Fe] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CC1(C)CC(C2=CC=CC=C2N)NC2=CC=C(Cl)C=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC#N.CN(C)C=O.COC1=CC=CC(CCl)=C1.O=C([O-])[O-].O=C1C=C(N2CCOCC2)N=C2N[C@H](C(F)(F)F)CCN21.[Cs+] , what product could potentially be produced?",
"input": "",
"output": "The product can be COC1=CC=CC(CN2C3=NC(N4CCOCC4)=CC(=O)N3CC[C@H]2C(F)(F)F)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCNC1=C2C(=O)C3=CC=CC=C3C(=O)C2=C(NCC)CC1.COC1=CCC(N)(NC2=C3C(=O)C4=CC=CC=C4C(=O)C3=CCC2)C=C1 Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " O=C1C2=C(NC3=CC=CC=C3)CCC(NC3=CC=CC=C3)=C2C(=O)C2=CC=CC=C12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.CCC(CC)C1=CC=C(Cl)C2=C1N1CCCCN(C3=NC=C(C#N)C=C3C)C1=N2.Cl.O=C([O-])O.[Li]C.[Na+] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CCC(CC)C1=CC=C(Cl)C2=C1N1CCCCN(C3=NC=C(C(C)=O)C=C3C)C1=N2 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)(C)OC(=O)N1CCN(C2=C3C=NNC3=NC=C2C2CCC2)CC1.ClCCl.O=C(O)C(F)(F)F Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " C1=NC2=C(C=NN2)C(N2CCNCC2)=C1C1CCC1.Cl ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(CCN)N1C=CN=C1.O=C(Cl)C1=CC=C(Cl)S1 Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CC(CCNC(=O)C1=CC=C(Cl)S1)N1C=CN=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(=O)OC(C)=O.CCCC1=NC2=CN=C3C=CC=CC3=C2N1CCCCNOC.CCN(CC)CC.ClCCl.O=C([O-])O.[Na+] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CCCC1=NC2=CN=C3C=CC=CC3=C2N1CCCCN(OC)C(C)=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C1=CC=CC=C1.CCOC(C)=O.COC1=CC=C(C(=O)C2=CC=C(Cl)C(Cl)=C2)C(Cl)=C1Cl.Cl.[Al+3].[Cl-] , what product could potentially be produced?",
"input": "",
"output": "The product can be O=C(C1=CC=C(Cl)C(Cl)=C1)C1=CC=C(O)C(Cl)=C1Cl .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC(=O)N(C)C.COC(OC)C1=CC(Cl)=CC=C1[N+](=O)[O-].NC1=CC=CC(S)=C1.O.O=C([O-])[O-].[K+] as the reactants and reagents.",
"input": "",
"output": " COC(OC)C1=CC(SC2=CC=CC(N)=C2)=CC=C1[N+](=O)[O-] ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1COCCO1.CCN(CC)CC.CCOC(=O)C1(C)CCN(C(=O)OC(C)(C)C)CC1.Cl.ClC1=CC=NC=C1 Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CCOC(=O)C1(C)CCN(C2=CC=NC=C2)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCOC(C)=O.CN1N=C(C2CC2)C=C1NC(=O)NC1=CC=CC(C(=O)C2=C3C(N)=NC=NN3C(Br)=C2)=C1.CO.[Pd] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CN1N=C(C2CC2)C=C1NC(=O)NC1=CC=CC(C(=O)C2=C3C(N)=NC=NN3C=C2)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CN(C)C=O.C[C@@H](NC(=O)OCC1=CC=CC=C1)C1=CC=C(C(=O)O)C=C1[N+](=O)[O-].ClCCl.O=S(Cl)Cl Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " C[C@@H](NC(=O)OCC1=CC=CC=C1)C1=CC=C(C(=O)Cl)C=C1[N+](=O)[O-] ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC1=CC=CC(Cl)=C1C(=O)Cl.COC1=CC=C(CN)C=C1.ClCCl.O ",
"input": "",
"output": " COC1=CC=C(CNC(=O)C2=C(C)C=CC=C2Cl)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. C1CCOC1.CC1(C)CCCC(C)(C)N1.CCCCCC.CCO.Cl.ClC1=CN=CC=N1.O=C1CN2CCC1C2.[Li]CCCC ",
"input": "",
"output": " OC1(C2=NC=CN=C2Cl)CN2CCC1C2 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. COC(=O)C1=CC=C2C(=C1)NC(=O)C1=CC=NC=C12.O=P(Cl)(Cl)Cl ",
"input": "",
"output": " COC(=O)C1=CC=C2C(=C1)N=C(Cl)C1=CC=NC=C12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " COC1=CC=C(CCC2(C3CCCC3)CC(=O)C(Cl)C(=O)O2)C=C1Cl.SCCC1=CC=CC=N1 Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " COC1=CC=C(CCC2(C3CCCC3)CC(O)=C(SCCC3=CC=CC=N3)C(=O)O2)C=C1Cl ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC(=O)O[C@H]1NC(=O)[C@@H]1[C@@H](C)O[Si](C)(C)C(C)(C)C.CCN(CC)CC.C[Si](C)(C)Cl.ClCCl is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC(=O)O[C@@H]1[C@@H]([C@@H](C)O[Si](C)(C)C(C)(C)C)C(=O)N1[Si](C)(C)C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC1=CC=C(C(=O)O)C=C1S(=O)(=O)Cl.CO.N .",
"input": "",
"output": " CC1=CC=C(C(=O)O)C=C1S(N)(=O)=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCCC1=C(O)C=CC2=C1ON=C2C1CC1.CCCCCC.CCOC(C)=O.CN(C)C=O.COC(=O)CC1=CC=C(NCCCBr)C(Cl)=C1.O=C([O-])[O-].[Cs+] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CCCC1=C(O)C=CC(C(=O)C2CC2)=C1O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1CCOC1.CO.COC(=O)C1=CC=C(C(=O)NC(C)C)C([N+](=O)[O-])=C1.[Pd] ",
"input": "",
"output": " COC(=O)C1=CC=C(C(=O)NC(C)C)C(N)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: COC(=O)C[C@@H]1COC2=CC(O[C@@H]3CCC4=C(O)C=CC(F)=C43)=CC=C21.COC1=CC=C(B(O)O)C=C1 , what product could potentially be produced?",
"input": "",
"output": "The product can be COC(=O)C[C@@H]1COC2=CC(O[C@@H]3CCC4=C(OC5=CC=C(OC)C=C5)C=CC(F)=C43)=CC=C21 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCCCN(CCCC)C(=S)NC(=O)C1=CC=C(C(C)(C)C)C=C1.O.O=C(O)CCl.[Na+].[OH-] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CCCCN(CCCC)C1=NC(C2=CC=C(C(C)(C)C)C=C2)=CS1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCCN.O=C(O)C1=C(C2=CC=CC=C2)C2=CC(Br)=CC=C2C(=O)N1CC1=CC=C2OCOC2=C1 Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CCCNC(=O)C1=C(C2=CC=CC=C2)C2=CC(Br)=CC=C2C(=O)N1CC1=CC=C2OCOC2=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CCS.O=C([O-])[O-].O=[N+]([O-])C1=CC=C(Cl)C(S(=O)(=O)CCO)=C1.[K+] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: O=[N+]([O-])C1=CC=C(CCS)C(S(=O)(=O)CCO)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)N(CCC(C#N)C1=CC=C(C2=CC=CC=C2)C=C1)C(C)C.CC(C)N(CCCl)C(C)C.CC1=CC=CC=C1.O.[NH2-].[Na+] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CC(C)N(CCC(C#N)(CCN(C(C)C)C(C)C)C1=CC=C(C2=CC=CC=C2)C=C1)C(C)C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C[Si](C)(C)CCOC(=O)N1CCN2C(=NN=C2C2=CN=CC=N2)C1=O.ClCCl.O=C(O)C(F)(F)F ",
"input": "",
"output": " O=C1NCCN2C1=NN=C2C1=CN=CC=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1=CC=C(P(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.CC(C)(C)OC(=O)NCCC1=CC2=C(O)N=CN=C2S1.ClC(Cl)(Cl)Cl.ClCCCl as the reactants and reagents.",
"input": "",
"output": " CC(C)(C)OC(=O)NCCC1=CC2=C(Cl)N=CN=C2S1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C1CCOC1.CCC(C#N)(C(=O)O)C(C)C1CC1.CO.[Na+].[OH-] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CC(C1CC1)C(C#N)C(=O)O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CC(=O)O.CC1=CC=C(N)C=C1.CCOC(OCC)N1CCNC1=N[N+](=O)[O-].CCOCC.CN1CCN(C)C1=O.O as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CC1=CC=C(N=CN2CCNC2=N[N+](=O)[O-])C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CC(C)(C)OC(=O)[C@@H](N)CC1=CC=CC=C1.CCN(CC)CC.Cl.ClCCl.O.O=C(Cl)CCl as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CC(C)(C)OC(=O)[C@H](CC1=CC=CC=C1)NC(=O)CCl .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCO.CCOC(=O)C(C)Br.CS(C)=O.S=C1N=CN(C2=CC=C(Cl)C(Cl)=C2)N1.[NaH] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CCOC(=O)C(C)SC1=NN(C2=CC=C(Cl)C(Cl)=C2)C=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C1CCOC1.CNC.ClCCl.O=C(Cl)C1=CN=NC(Cl)=C1 as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CN(C)C(=O)C1=CN=NC(Cl)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CC(C)NC(C)C.CCOC(C)=O.ClC(Cl)Cl.ClCCl.O=C(N1C=CN=C1)N1C=CN=C1.O[C@H](CCl)CNCC1=CC=CC=C1 as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " O=C1O[C@H](CCl)CN1CC1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CC(C)O.CCN(CC)CC.CCOC(=O)C1CC2(CCN(C3=NC(N)=NC(Cl)=N3)CC2)CN1C(=O)OCC1=CC=CC=C1.NCC1=CC=C2C=CC=CC2=C1 as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CCOC(=O)C1CC2(CCN(C3=NC(N)=NC(NCC4=CC=C5C=CC=CC5=C4)=N3)CC2)CN1C(=O)OCC1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC1=NN(C2=CC=C(O)C=C2F)C(I)=C1C#N.CCCC[Sn](CCCC)(CCCC)C1=C(C)SC=C1C.Cl[Pd](Cl)([PH](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1)[PH](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CC1=CSC(C)=C1C1=C(C#N)C(C)=NN1C1=CC=C(O)C=C1F .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " ClC(Cl)Cl.NCC1=CC=CC=C1.O=C1CCN(C(=O)C2=CC=C3NC(=O)CCC3=C2)CC1 Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be O=C1CCC2=CC(C(=O)N3CCC(=NCC4=CC=CC=C4)CC3)=CC=C2N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CCOCC.CO.COC(=O)C1OC1(C)C1=CC=CC(OC)=C1.FB(F)F ",
"input": "",
"output": " COC(=O)C(O)C(C)(OC)C1=CC=CC(OC)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)(C)OC(=O)N[C@H](C(=O)O)C(C1=CC=CC=C1)C1=CC=CC=C1.CC(C)CN([C@H](CO)CCCCN)S(=O)(=O)C1=CC=C(F)C(N)=C1 Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CC(C)CN([C@H](CO)CCCCNC(=O)[C@@H](NC(=O)OC(C)(C)C)C(C1=CC=CC=C1)C1=CC=CC=C1)S(=O)(=O)C1=CC=C(F)C(N)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C1=CC(CCC2=NCCCCN2)=CC=N1.CCO.Cl.NC1=C(F)C(N)=C(F)C(F)=C1F.O=[Pt]=O.[H][H] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: C1CCNC(CCC2CCNCC2)=NC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC1=CC=CC=C1.CN1CCNCC1.ClCCCBr is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CN1CCN(CCCCl)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CCOC(=O)CCCOC1=CC=CC=C1NC(=O)CCCCCCCCCCCSC(C)C.CO.ClCCl.N as the reactants and reagents.",
"input": "",
"output": " CC(C)SCCCCCCCCCCCC(=O)NC1=CC=CC=C1OCCCC(N)=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.NN.O.O=C(CC(F)(F)F)C1=CC=CC([N+](=O)[O-])=C1 Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be NN=C(CC(F)(F)F)C1=CC=CC([N+](=O)[O-])=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CC(=O)OCC(CCl)OC1CCCCO1.O.[Na+].[OH-] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: C1CCC(OC2COC2)OC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CON(C)C(=O)C1=CC=C(COC[C@@H]2C[C@@H]2C2CCN(C(=O)OC(C)(C)C)CC2)C=C1F.ClC1=CN=C(Cl)N=C1.ClCCl.O.O=C(O)C(F)(F)F.O=C([O-])[O-].[Cs+] , what product could potentially be produced?",
"input": "",
"output": "The product can be CON(C)C(=O)C1=CC=C(COC[C@@H]2C[C@@H]2C2CCN(C3=NC=C(Cl)C=N3)CC2)C=C1F .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C1CCOC1.CCCCNC1CC(C)(C)N(OC2CCCCC2)C(C)(C)C1.CCN(CC)CC.CCOC(C)=O.O=C1CCC(=O)O1 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CCCCN(C(=O)CCC(=O)O)C1CC(C)(C)N(OC2CCCCC2)C(C)(C)C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1COCCO1.CC1=CC=C(N)C=C1C(=O)C1=CC=C(NC2=CC=C(F)C=C2F)C=C1Cl.O=C=NCCC1=CC=CC=C1 Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CC1=CC=C(NC(=O)NCCC2=CC=CC=C2)C=C1C(=O)C1=CC=C(NC2=CC=C(F)C=C2F)C=C1Cl ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CN(C)C=O.COC1=CC2=C(Cl)N=CN=C2C=C1OCCCN1CCCCC1.C[Si](C)(C)N[Si](C)(C)C.NC1=C(Br)C=CC2=C1OCO2.O.[NaH] as the reactants and reagents.",
"input": "",
"output": " COC1=CC2=C(NC3=C(Br)C=CC4=C3OCO4)N=CN=C2C=C1OCCCN1CCCCC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)C[AlH]CC(C)C.CCOC(=O)[C@H](C)O[Si](C)(C)C(C)(C)C.CO.ClCCl.O=C([O-])C(O)C(O)C(=O)[O-].[K+].[Na+] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " C[C@@H](C=O)O[Si](C)(C)C(C)(C)C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C1CCNC1.CCOC(=O)C1=CN(C2=NC3=CC(C)=C(OC4=C(C)C=CC=C4C)C=C3C(=O)N2)N=C1 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC1=CC2=NC(N3C=C(C(=O)O)C=N3)=NC(N3CCCC3)=C2C=C1OC1=C(C)C=CC=C1C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using COC1CCCN(C2=CC=C(N)C=N2)C1.O=C(O)C1=C(C(F)(F)F)OC(C2=CC=CC=C2)=N1 as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " COC1CCCN(C2=CC=C(NC(=O)C3=C(C(F)(F)F)OC(C4=CC=CC=C4)=N3)C=N2)C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC1=CC=CC=C1.CCN(CC)CC.CCOC(C)=O.COC1=C(C)C2=C(C(=O)OC2)C(O[Si](C)(C)C(C)(C)C)=C1C[C@H](OC(=O)NC[C@@]1(C)C=CC=CC1)C1=CCCC1.Cl[SiH](Cl)Cl Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be COC1=C(C)C2=C(C(=O)OC2)C(O[Si](C)(C)C(C)(C)C)=C1C[C@H](O)C1=CCCC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CCO.NC(=S)/C=C/C1=CC=CC([N+](=O)[O-])=C1.O=C(CBr)C1CCCCCCC1 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: O=[N+]([O-])C1=CC=CC(/C=C/C2=NC(C3CCCCCCC3)=CS2)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1COCCN1.O=C(CCl)NC1=CC=C2N=C(NC3CCOC4=CC=CC=C43)OCC2=C1 ",
"input": "",
"output": " O=C(CN1CCOCC1)NC1=CC=C2N=C(NC3CCOC4=CC=CC=C43)OCC2=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using COC1=CC=CC(C2=CC(C3=CC=CC=N3)=CN(C3=CC=CC=C3)C2=O)=N1.Cl as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " O=C1C(C2=CC=CC(O)=N2)=CC(C2=CC=CC=N2)=CN1C1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: BrCC1=CC=CC(I)=C1.CN(C)C=O.NC(=O)NC1NC(=O)NC1=O.[H-].[Na+] , what product could potentially be produced?",
"input": "",
"output": "The product can be NC(=O)NC1NC(=O)N(CC2=CC=CC(I)=C2)C1=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC1=NN=C(C2=CC=C3OC=C(Br)C3=N2)O1.OB(O)C1=CC(F)=CC=C1F Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CC1=NN=C(C2=CC=C3OC=C(C4=CC(F)=CC=C4F)C3=N2)O1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C=O.CO.NC1=CC=C2N=CC=CC2=C1.O.[BH3-]C#N.[Na+] , what product could potentially be produced?",
"input": "",
"output": "The product can be CN(C)C1=CC=C2N=CC=CC2=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)O.CCC1CN(C(CC2=CC=C3C=CC=CC3=C2)C(=O)NC)CCN1C(=O)C(N)CC1=CC=C(Cl)C=C1.CCN=C=NCCCN(C)C.CCOC(C)=O.CN(C)C=O.CN1CCOCC1.Cl.O.ON1N=NC2=CC=CC=C21 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CCC1CN(C(CC2=CC=C3C=CC=CC3=C2)C(=O)NC)CCN1C(=O)CN(CC1=CC=C(Cl)C=C1)C(=O)C1CCCN1C(=O)OC(C)(C)C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C1CCOC1.CC1=C(Cl)C(S(C)=O)=NC2=C1C(N)=C(C(=O)NC1CC1)S2.C[Si](C)(C)[N-][Si](C)(C)C.OCCN1CCNCC1.[Li+] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CC1=C(Cl)C(OCCN2CCNCC2)=NC2=C1C(N)=C(C(=O)NC1CC1)S2 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CC(C)(C)C1=NC(C2=CC=CC(NS(=O)(=O)C3=CC(F)=CC=C3F)=C2F)=C(C2=CC=NC(Cl)=N2)S1.NCC(F)(F)F as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CC(C)(C)C1=NC(C2=CC=CC(NS(=O)(=O)C3=CC(F)=CC=C3F)=C2F)=C(C2=CC=NC(NCC(F)(F)F)=N2)S1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C1=CC=C2NC=CC2=C1.CCN(CC)CC.ClCCCl.ClCCl.O=[N+]([O-])C1=CC=CC(S(=O)(=O)Cl)=C1 .",
"input": "",
"output": " O=[N+]([O-])C1=CC=CC(S(=O)(=O)N2C=CC3=CC=CC=C32)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C=CC1=CC(Br)=CC(C(=O)OC)=C1.ClCCl.O=C(OO)C1=CC=CC(Cl)=C1.O=C([O-])O.[Na+] as the reactants and reagents.",
"input": "",
"output": " COC(=O)C1=CC(Br)=CC(C2CO2)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if N.O=S(=O)(C1=CC=CC=C1)C1=CN=C(Cl)C=N1.[NH4+].[OH-] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " NC1=CN=C(S(=O)(=O)C2=CC=CC=C2)C=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C1=CC=C([PH](C2=CC=CC=C2)(C2=CC=CC=C2)[Pd]([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)[PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.CC1=C(C=O)C=C(Br)N1S(=O)(=O)C1=CC=CC=C1.COCCOC.O.O=C([O-])[O-].OB(O)C1=CC=CN=C1.[Na+] .",
"input": "",
"output": " CC1=C(C=O)C=C(C2=CC=CN=C2)N1S(=O)(=O)C1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1CCOC1.CC1=CC(C(=O)O)=CC=C1C(=O)N1CCCC1.CCN(C(C)C)C(C)C.CCNC(C)C1=NC2=CC=C(Cl)C=C2N1.CCO.CN(C)C(ON1N=NC2=CC=CC=C21)=[N+](C)C.ClCCl.ClCl.F[B-](F)(F)F ",
"input": "",
"output": " CCN(C(=O)C1=CC=C(C(=O)N2CCCC2)C(C)=C1)C(C)C1=NC2=CC(Cl)=CC=C2N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CO.ClC1=NC(Cl)=C2NC=NC2=N1.N Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be NC1=NC(Cl)=NC2=C1NC=N2 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC1CC2=CC=C(C3CCNCC3)C=C2CN1C1=CC(N2CCN(C)CC2)=NC(N)=N1.CCC(=O)Cl.Cl ",
"input": "",
"output": " CCC(=O)N1CCC(C2=CC=C3CC(C)N(C4=CC(N5CCN(C)CC5)=NC(N)=N4)CC3=C2)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. C1CCOC1.CC(=O)O.CNC1=CC(OC2=CC=C3N=CC=CC3=C2)=NC=N1.O=[Pt]=O ",
"input": "",
"output": " CNC1=CC(OC2=CC=C3NCCCC3=C2)=NC=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1COCCO1.COC1=NC2=CC(Cl)=C(Cl)C(CN3N=NC4=CC(CN(C)C)=CC=C43)=C2N=C1OC.Cl Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CN(C)CC1=CC=C2C(=C1)N=NN2CC1=C(Cl)C(Cl)=CC2=C1NC(=O)C(=O)N2 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC1=NOC(C)=C1B(O)O.CN(C(=O)C1=CC(C(F)(F)F)=CC(C(F)(F)F)=C1)C1=CN=CC=C1Br.CN(C)C=O ",
"input": "",
"output": " CC1=NOC(C)=C1C1=CC=NC=C1N(C)C(=O)C1=CC(C(F)(F)F)=CC(C(F)(F)F)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC1=CC=C(NC(=O)C(C)C)C=C1C1CCN(CCCN)CC1.O=C(O)C1(C2=CC=C(Cl)C=C2)CCCC1 as the reactants and reagents.",
"input": "",
"output": " CC1=CC=C(NC(=O)C(C)C)C=C1C1CCN(CCCNC(=O)C2(C3=CC=C(Cl)C=C3)CCCC2)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CC=NC=C1.CC#N.CC(=O)N1CCC(C(Cl)=NOS(C)(=O)=O)CC1.CC1=NN=CC=C1OC1=CC(Br)=CN=C1N.N#C[S-].O.[Na+] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CC(=O)N1CCC(C2=NSC(NC3=NC=C(Br)C=C3O)=N2)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C1=CC=NC=C1.CN1CCN(C2=CC=C(C(=O)Cl)C(N(C(=O)C(F)(F)F)C3CCOCC3)=C2)CC1.NC1=NNC2=CC=C(OCC3=CC=CC=C3)C=C12 , what product could potentially be produced?",
"input": "",
"output": "The product can be CN1CCN(C2=CC=C(C(=O)NC3=NNC4=CC=C(OCC5=CC=CC=C5)C=C34)C(N(C(=O)C(F)(F)F)C3CCOCC3)=C2)CC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CS(=O)(=O)Cl.NC1=CC=C(C2=CC(C3=CC4=NN(CC5=CC=CC=C5)C=C4C=C3)=C3C(N)=NC=NN23)C=C1 .",
"input": "",
"output": " CS(=O)(=O)NC1=CC=C(C2=CC(C3=CC4=NN(CC5=CC=CC=C5)C=C4C=C3)=C3C(N)=NC=NN23)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)(O)CC1=CN(N)C2=CC=C(F)C=C12.CC1=CC=CC=C1.CC1=NC(C2=CC=CC(F)=C2)=NC=C1C(=O)O.CN(C)C1=CC=NC=C1.CN(C)C=O.ClCCl.O=C(Cl)C(=O)Cl.O=C([O-])[O-].[Na+] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CC1=NC(C2=CC=CC(F)=C2)=NC=C1C(=O)NN1C=C(CC(C)(C)O)C2=CC(F)=CC=C21 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC#N.C[N+]1=CN(S(=O)(=O)N2C=CN=C2)C=C1.NC1=C(CNC2=CC=CC=C2)C=CC2=CC=CN=C12.O=S(=O)([O-])C(F)(F)F .",
"input": "",
"output": " O=S1(=O)NC2=C(C=CC3=CC=CN=C23)CN1C1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.CCCCCC.O=C(Cl)N1CC2=CC=CC=C2OC2=CC=C(Cl)C=C21.OCCCNCC1=CC=NC=C1.[LiH].[Li]CCCC Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be O=C(OCCCNCC1=CC=NC=C1)N1CC2=CC=CC=C2OC2=CC=C(Cl)C=C21 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CC=C([PH](C2=CC=CC=C2)(C2=CC=CC=C2)[Pd]([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)[PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.C1COCCO1.CC[C@H]1C[C@@H](NC2=CC=CC=C2)C2=CC(Br)=CC=C2N1C(C)=O.O.O=C([O-])[O-].O=CC1=CC=C(B(O)O)C=C1.[K+] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CC[C@H]1C[C@@H](NC2=CC=CC=C2)C2=CC(C3=CC=C(C=O)C=C3)=CC=C2N1C(C)=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C#CC(O)C1=CC=CC2=C1OCCC2(C)C.CCN(CC)CC.CCOCC.COC(=O)C1=CC=C(I)C=C1O.Cl[Pd](Cl)([PH](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1)[PH](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1.I[Cu]I.O as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " COC(=O)C1=CC=C(C#CC(O)C2=CC=CC3=C2OCCC3(C)C)C=C1O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CCOC(=O)N1CC2CC(CCC3OCCCO3)N(CC3=CC=CC=C3)C2C1.Cl.NNC1=CC=C(N2C=CN=C2)C=C1.O=S(=O)(O)O.[Na+].[OH-] as the reactants and reagents.",
"input": "",
"output": " CCOC(=O)N1CC2CC(CC3=CNC4=CC=C(N5C=CN=C5)C=C34)N(CC3=CC=CC=C3)C2C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: COC1=CC=C(C(=O)CC2=C(Cl)C=NC=C2Cl)C=C1OC.COC1=CC=C(C(=O)Cl)C=C1 .",
"input": "",
"output": " COC1=CC=C(C(=O)O/C(=C\\C2=C(Cl)C=NC=C2Cl)C2=CC=C(OC)C(OC)=C2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CCOC(OCC)OC(C)=O.CCOP(=O)(CCCCONC1=NC=NC(Cl)=C1NC=O)OCC ",
"input": "",
"output": " CCOP(=O)(CCCCON1C=NC2=C(Cl)N=CN=C21)OCC ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C1COCCO1.CC1=CC=C(S(=O)(=O)N2C=CC3=C2N=CC2=C(Br)N=C(C)N23)C=C1.CCO.O.O=C([O-])[O-].O=CC1=CC=C(B(O)O)C=C1.[Cs+].[Pd] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CC1=NC(C2=CC=C(C=O)C=C2)=C2C=NC3=C(C=CN3)N12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if COC(=O)CCC(C)C(=O)N[C@@H](CC1=CC=C(O)C=C1)C(=O)O.COC(=O)CCC(C)C(=O)N[C@@H](CC1=CC=C(O)C=C1)C(=O)OCC1=CC=CC=C1.C[C@H](N)C(=O)OCC1=CC=CC=C1.N[C@@H](CC1=CC=C(O)C=C1)C(=O)OCC1=CC=CC=C1 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC(CCC(=O)O)C(=O)N[C@@H](CC1=CC=C(O)C=C1)C(=O)O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C1=CC=NC=C1.CC(C)(C)OC(=O)OC(=O)OC(C)(C)C.CCOC(C)=O.CNCCO.O=C(Cl)C1=CC=CC=C1 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CNCCOC(=O)C1=CC=CC=C1.Cl .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CN(C(=O)CBr)C1=CC=C(OCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC2=CC=CC=C2)[C@H](O)C(=O)N2CCC[C@H]2C(=O)NC(C)(C)C)C=C1.CNC ",
"input": "",
"output": " CN(C)CC(=O)N(C)C1=CC=C(OCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC2=CC=CC=C2)[C@H](O)C(=O)N2CCC[C@H]2C(=O)NC(C)(C)C)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CC(C)O.CC1=C(SCCCSC2=NN3C([N+](=O)[O-])=CN=C3C=C2)C=CN=C1CCl.CN(C)C=O.SC1=NC2=CC=C(C3=NC=CS3)C=C2N1 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CC1=C(SCCCSC2=NN3C([N+](=O)[O-])=CN=C3C=C2)C=CN=C1CSC1=NC2=CC(C3=NC=CS3)=CC=C2N1.Cl .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " O=S(=O)(Cl)C1=C(Cl)SC(Cl)=C1.O=S(=O)(O)O.O=[N+]([O-])O Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be O=[N+]([O-])C1=C(Cl)SC(Cl)=C1S(=O)(=O)Cl .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC1(C2=CC=CN=C2)CO1.CC1CC2=C(CN1C)C1=CC(Cl)=CC=C1N2.CN(C)C=O.[H-].[Na+] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CC1CC2=C(CN1C)C1=CC(Cl)=CC=C1N2CC(C)(O)C1=CC=CN=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if N#N.O.O=C1CN(C2=CC3=CC=C(OCC4=CC=CC=C4)C=C3C=C2OCC2=CC=CC=C2)S(=O)(=O)N1.[KH].[Pd] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " O=C1CN(C2=CC3=CC=C(O)C=C3C=C2O)S(=O)(=O)N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses COC(C(=O)O)C1=NC2=CC=CC=C2N1CCOCC1=CC=CC=C1.Cl.N=C(NC(=O)OCC1=CC=CC=C1)C1=CC=C(CN)C=C1 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: COC(C(=O)NCC1=CC=C(/C(N)=N/C(=O)OCC2=CC=CC=C2)C=C1)C1=NC2=CC=CC=C2N1CCOCC1=CC=CC=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: COC1=CC=C(C2=CC3=CC=CC=C3S2)C=C1.Cl.O=C(O)C1=CC=C(CCCN2CCCC2)C=C1 .",
"input": "",
"output": " COC1=CC=C(C2=C(C(=O)C3=CC=C(CCCN4CCCC4)C=C3)C3=CC=CC=C3S2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCCN1CC(C)=C(NS(C)(=O)=O)C2=C1N1CN(O)C=C1C=N2.CN(C)C=O.O=C(O)C(F)(F)Cl.[Na+].[OH-] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CCCN1CC(C)=C(NS(C)(=O)=O)C2=C1N1CN(OC(F)F)C=C1C=N2 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CC1(C)C2=CC(Cl)=CC=C2C(=O)N1C1=CN=CC(CCl)=C1.CN1C=C(B2OC(C)(C)C(C)(C)O2)C=N1 as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CN1C=C(CC2=CN=CC(N3C(=O)C4=CC=C(Cl)C=C4C3(C)C)=C2)C=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CCCCCC(O)CCCC(CCCCCCC(=O)O)S(C)(=O)=O.CCCCCC(O)CCCC(CCCCOCC(=O)O)SC as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CCCCCC(O)CCCC(CCCCOCC(=O)O)S(C)(=O)=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.C=CC(=O)OC.CC(C)(C)[O-].CC1(C)CC(OCC2=CC=CC=C2)CC(C)(C)N1O.O=S(=O)([O-])[O-].[K+].[Mg+2].[Pd] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be COC(=O)CCON1C(C)(C)CC(OCC2=CC=CC=C2)CC1(C)C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CO.COC1=CC=C(C2=CCN(C(=O)OC(C)(C)C)CC2)C2=C1N=C(NC(=O)N1CCOCC1)S2.Cl as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: COC1=CC=C(C2=CCNCC2)C2=C1N=C(NC(=O)N1CCOCC1)S2 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if Cl.N=C(CC1=NC2=CN=C3C=CC(Cl)=CC3=C2N1C1=CC=CC=C1Cl)NO.O.[Ni] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " N=C(N)CC1=NC2=CN=C3C=CC(Cl)=CC3=C2N1C1=CC=CC=C1Cl ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C1=CC=NC=C1.COC(=N)C1=CC=CC=C1.Cl.NNC(=O)C1=CC=C(CN2CCCCCC2)S1 , what product could potentially be produced?",
"input": "",
"output": "The product can be C1=CC=C(C2=NN=C(C3=CC=C(CN4CCCCCC4)S3)O2)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CN(C)C=O.C[Si](C)(C)CCOCCl.NC(=O)CNS(=O)(=O)C1=CC=CC(I)=C1.O=P([O-])([O-])[O-].[H-].[Na+] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be C[Si](C)(C)CCOCN(CC(N)=O)S(=O)(=O)C1=CC=CC(I)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CCCCOC(=O)C1=NC(Br)=C2C=CC(OC3=CC=C(OC)C=C3)=CC2=C1O.N#C[Cu] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CCCCOC(=O)C1=NC(C#N)=C2C=CC(OC3=CC=C(OC)C=C3)=CC2=C1O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC(C)=O.CC1=C(CC2=CC3=CC=CC=C3S2)C=C(C2OC(CO)CC(O)C2O)C(O)=C1C.CI.O=C([O-])[O-].[Cs+] ",
"input": "",
"output": " COC1=C(C2OC(CO)CC(O)C2O)C=C(CC2=CC3=CC=CC=C3S2)C(C)=C1C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC(C)C(CI)C(=O)N1C(=O)OC[C@H]1CC1=CC=CC=C1.CC([O-])=S.CN(C)C=O.O.[K+] .",
"input": "",
"output": " CC(=O)SC[C@@H](C(=O)N1C(=O)OC[C@H]1CC1=CC=CC=C1)C(C)C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CCCCCCNC(=O)CCCN(C)C(=O)OCC1=CC=CC=C1.CCO.[H][H].[Pd] , what product could potentially be produced?",
"input": "",
"output": "The product can be CCCCCCNC(=O)CCCNC .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CN[C@H]1CCNC1.O=[N+]([O-])C1=CN=C(Cl)N=C1 as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CN[C@H]1CCN(C2=NC=C([N+](=O)[O-])C=N2)C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. C1CCOC1.C[Mg]Cl.N#CC1(N2CCNCC2)CCN(CC2=CC=CC=C2)CC1.[Cl-].[NH4+] ",
"input": "",
"output": " CC1(N2CCNCC2)CCN(CC2=CC=CC=C2)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CN(C)C=O.COC1=CN=C(CN)C=C1O.COC=C1C(=O)NC(=O)C2=CC=C(N3C=CC=C3)C=C12 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: COC1=CC=C(CNC=C2C(=O)NC(=O)C3=CC=C(N4C=CC=C4)C=C23)C=C1O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: BrCC1=CSC=N1.C1COCCN1.CCN(CC)CC.CN(C)C=O .",
"input": "",
"output": " C1=NC(CN2CCOCC2)=CS1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC1CCNCC1.CCN(CC)CC.CCOCC.ClCCl.O=C(Cl)CCl as the reactants and reagents.",
"input": "",
"output": " CC1CCN(C(=O)CCl)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C1CCOC1.CC(C)(C)[O-].CCOP(=O)(CC#N)OCC.O.O=C1CCS(=O)(=O)CC1.[K+] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " N#CC=C1CCS(=O)(=O)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CC(C)(C)OC(=O)N1CC2CC1CN2.CN(C)C=O.O.O=C([O-])[O-].O=[N+]([O-])C1=CC=C(F)C=C1.[K+] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CC(C)(C)OC(=O)N1CC2CC1CN2C1=CC=C([N+](=O)[O-])C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C1CCOC1.CC(=O)OC=O.CCCC#CC(CS(=O)(=O)N1CCN(C2=CC=CC=N2)CC1)NO .",
"input": "",
"output": " CCCC#CC(CS(=O)(=O)N1CCN(C2=CC=CC=N2)CC1)N(O)C=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CO.COC(=O)[C@@H]1C[C@H](NC(=O)C2=CC=C3C=CC=CC3=C2O)CN1CC1CCCCC1.Cl.[Li+].[OH-] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: O=C(N[C@H]1C[C@@H](C(=O)O)N(CC2CCCCC2)C1)C1=CC=C2C=CC=CC2=C1O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C1COCCO1.CC(=O)[O-].CC1(C)OB(B2OC(C)(C)C(C)(C)O2)OC1(C)C.COC1=CC=CC=C1S(=O)(=O)N1CCN(C2=CN=C3C=CC(Br)=CC3=N2)CC1.COC1=NC=C(Br)C=C1NS(=O)(=O)C1CC1.O=C([O-])[O-].[K+] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: COC1=CC=CC=C1S(=O)(=O)N1CCN(C2=CN=C3C=CC(C4=CN=C(OC)C(NS(=O)(=O)C5CC5)=C4)=CC3=N2)CC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC(=O)O[BH-](OC(C)=O)OC(C)=O.CC1=NCCC2=C1C=CC=C2C(F)(F)F.[Na+] , what product could potentially be produced?",
"input": "",
"output": "The product can be CC1NCCC2=C1C=CC=C2C(F)(F)F .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC1=C(Cl)C=NC=C1Cl.CN(C)C=O.COC1=CC=C2C(Cl)=NN=C(CCCCC3=CC=CC=C3)C2=C1.[H-].[Na+] ",
"input": "",
"output": " COC1=CC=C2C(CC3=C(Cl)C=NC=C3Cl)=NN=C(CCCCC3=CC=CC=C3)C2=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " BrC1=NC=CC=N1.CCOCC.CN1CCCC1.O=[N+]([O-])C1=CC=C2NCCC2=C1.[H-].[Na+] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " O=[N+]([O-])C1=CC=C2C(=C1)CCN2C1=NC=CC=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CCOP(=O)(OCC)C1=CC=C(N)C=C1.CN1CC2=C(Cl)C=C(Cl)C=C2C(C2=CC=CC(S(=O)(=O)NCCP(=O)(O)O)=C2)C1 .",
"input": "",
"output": " CN1CC2=C(Cl)C=C(Cl)C=C2C(C2=CC=CC(S(=O)(=O)NC3=CC=C(P(=O)(O)O)C=C3)=C2)C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) NCC1=CC=C2OCOC2=C1.O=C1NC2=NC=CC=C2C2=CC(Cl)=CC=C12 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: O=C1NC2=NC=CC=C2C2=CC(NCC3=CC=C4OCOC4=C3)=CC=C12 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C.CCOC(C)=O.CO.COC(=O)C1=CC(OC)=C(C2=CC=CC=C2)C=C1NC(=O)C1=CC(N2CCCCC2)=CC=C1OCC1=CC=CC=C1.[Pd] ",
"input": "",
"output": " COC(=O)C1=CC(OC)=C(C2=CC=CC=C2)C=C1NC(=O)C1=CC(N2CCCCC2)=CC=C1O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC(=O)O.CC(C)(C)CC(=O)C(C)(C)C.CCCCO.N=CN as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CC(C)(C)C1=CN=CN=C1C(C)(C)C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC(=O)OCCN=C=S.CC1=CC(C)=CC(CC(N)C2=CC=CC3=C2CCCC3)=C1.ClC(Cl)Cl as the reactants and reagents.",
"input": "",
"output": " CC(=O)OCCNC(=S)NC(CC1=CC(C)=CC(C)=C1)C1=CC=CC2=C1CCCC2 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCOC(=O)CC1=CC=C(NC(=O)C(COC2CCCCO2)NC(=O)OCC2=CC=CC=C2)C=C1.O=[N+]([O-])C1=CC(S(=O)(=O)Cl)=CC=C1Cl.[Pd] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CCOC(=O)CC1=CC=C(NC(=O)C(COC2CCCCO2)NS(=O)(=O)C2=CC=C(Cl)C([N+](=O)[O-])=C2)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CNC1=NC2=CC=CC=C2O1.O=[N+]([O-])O Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CNC1=NC2=CC=C([N+](=O)[O-])C=C2O1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCO.O=CC1=CC=C2CNCC(=O)N3C=CC1=C23.[BH4-].[Na+] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " O=C1CNCC2=CC=C(CO)C3=C2N1C=C3 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC(C)(C)OC(=O)NCCCCCO.CCN(CC)CC.CCOC(C)=O.O.O=C(Cl)OC1=CC=C([N+](=O)[O-])C=C1 ",
"input": "",
"output": " CC(C)(C)OC(=O)NCCCCCOC(=O)OC1=CC=C([N+](=O)[O-])C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CO.C[N+]1(C)CCCC2=C(N=NC3=CC=CC=C3)C=CC(O)=C21.O.[Br-].[H][H].[Pd] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be C[N+]1(C)CCCC2=C(N)C=CC(O)=C21 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C=CC/C=C\\C/C=C\\CCCCCCCC1=CC=CC(O)=C1.CC(=O)OC(C)=O.CC1=CC=C(S(=O)(=O)O)C=C1 , what product could potentially be produced?",
"input": "",
"output": "The product can be C=CCC=CCC=CCCCCCCCC1=CC=CC(OC(C)=O)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CC=NC=C1.CC(=O)N1C2=CC=C(NC(=O)C3=CC=CC=C3O)C=C2C(C)(C2=CC=CC=C2)CC1(C)C.CS(=O)(=O)Cl Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CC(=O)N1C2=CC=C(NC(=O)C3=CC=CC=C3OS(C)(=O)=O)C=C2C(C)(C2=CC=CC=C2)CC1(C)C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CCOC(=O)CBr.CCOC1=CC2=C(C=C1OCC)C(C1=CC=CC=C1)=NCC(=O)N2.CI as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CCOC(=O)CN1C(=O)CN=C(C2=CC=CC=C2)C2=CC(OCC)=C(OCC)C=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C=O.CC(=O)O.CO.NC1=CC=C2C=CC(=O)N(C3CCN(CC4=CC=CC=C4)CC3)C2=C1.O.O=C([O-])[O-].[BH3-]C#N.[K+].[Na+] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CN(C)C1=CC=C2C=CC(=O)N(C3CCN(CC4=CC=CC=C4)CC3)C2=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) COC(=O)C1CC(N)CN1C(=O)OC(C)(C)C.COC1=CC=C2N=CC3=C(CC(CBr)CS3)C2=C1.O=C1CSC2=CC=C(C(=O)O)C=C2N1 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: COC(=O)C1CC(NC(=O)C2=CC=C3SCC(=O)NC3=C2)CN1CC1CSC2=CN=C3C=CC(OC)=CC3=C2C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC=O.CCC(O)(CO)C1=CC(F)=CC(SC2=CC=C3C=CC=CC3=C2)=C1 Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CCC1(C2=CC(F)=CC(SC3=CC=C4C=CC=CC4=C3)=C2)COC(C)O1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if COC1=CC=C(CN2C(=O)C(O)(C3=CC4=C(C=C3O)OCC4)C3=C2C=CC2=NC=CC=C32)C=C1.O=C1N(C(C2=CC=CC=C2)C2=CC=CC=C2)C2=CC3=C(C=C2C1(O)C1=CC2=C(C=C1O)OCC2)OCCO3 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " COC1=CC=C(CN2C(=O)C(C3=CC4=C(C=C3O)OCC4)C3=C2C=CC2=NC=CC=C32)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C1=CC=C(P(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.CC#N.CN1C=C(B2OC(C)(C)C(C)(C)O2)C=N1.FC1=CC(OCC2=NC3=CC=CC=C3N2)=C(F)C=C1CC1=CNC2=NC=C(Br)C=C12.O.O=C([O-])[O-].[K+].[Pd] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CN1C=C(C2=CN=C3NC=C(CC4=CC(F)=C(O)C=C4F)C3=C2)C=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with COC(=O)C(CC1=CC=CC(CCO)=C1)C(=O)OC.O=C=NC1=CC=C(Cl)C=C1Cl as the reactants and reagents.",
"input": "",
"output": " COC(=O)C(CC1=CC=CC(CCOC(=O)NC2=CC=C(Cl)C=C2Cl)=C1)C(=O)OC ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1=CC=CC=C1.C1COCCO1.CCCCC[C@H]1CC[C@H](CC[C@H]2CC[C@H](C3=CC=C(C(=O)O)C=C3)CC2)CC1.N.O.O=S(Cl)Cl ",
"input": "",
"output": " CCCCC[C@H]1CC[C@H](CC[C@H]2CC[C@H](C3=CC=C(C(N)=O)C=C3)CC2)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CCO.COC(=O)C1=CC2=CC(SC)=CC=C2N1S(=O)(=O)C1=CC=CC=C1.NN.O.O=P(Cl)(Cl)Cl , what product could potentially be produced?",
"input": "",
"output": "The product can be CSC1=CC=C2C(=C1)C=C(C1=NN=CO1)N2S(=O)(=O)C1=CC=CC=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. O.SC1=NC(C2=CC=CC=C2)=NS1.[NH4+].[Na+].[O-]Cl.[OH-] ",
"input": "",
"output": " NSC1=NC(C2=CC=CC=C2)=NS1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC(C)(C)OO.CC(C)[O-].CC1=CC=CC=C1.ClC(Cl)(Cl)Cl.ClCCl.O=C(O)C(O)C(O)C(=O)O.OCC=CC1=CC=CC(C2=NN(C(C3=CC=CC=C3)(C3=CC=CC=C3)C3=CC=CC=C3)N=N2)=C1.[Ti+4] as the reactants and reagents.",
"input": "",
"output": " OC[C@@H]1O[C@H]1C1=CC=CC(C2=NN(C(C3=CC=CC=C3)(C3=CC=CC=C3)C3=CC=CC=C3)N=N2)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C1CCOC1.CC(=O)O.CO.COC(=O)[C@@H]1CCC[C@@H]1C(=O)NC1=NC(C2=CC=C(C(=O)NC3CC3)C=C2)=CS1.O.[Li+].[OH-] , what product could potentially be produced?",
"input": "",
"output": "The product can be O=C(NC1CC1)C1=CC=C(C2=CSC(NC(=O)[C@H]3CCC[C@H]3C(=O)O)=N2)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CCOC(=O)C(=O)NC1=CC2=C3C(=CC=CC3=C1)C(=O)OC2=O.O=S(=O)(O)O.O=[N+]([O-])[O-].[K+] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CCOC(=O)C(=O)NC1=CC2=C3C(=CC=CC3=C1[N+](=O)[O-])C(=O)OC2=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C[C@@]1(C2=CC(N)=CC=C2F)C[C@@H](C(F)(F)F)OC(N)=N1.O=C(O)C1=CN=C(CF)C=N1 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " C[C@@]1(C2=CC(NC(=O)C3=CN=C(CF)C=N3)=CC=C2F)C[C@@H](C(F)(F)F)OC(N)=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CCC1=CC(C(=O)OC)=C(N)S1.CCN(CC)CC.ClCCl.NCCC1=CC=CC=C1.O=C(OC(Cl)(Cl)Cl)OC(Cl)(Cl)Cl .",
"input": "",
"output": " CCC1=CC2=C(NC(=O)N(CCC3=CC=CC=C3)C2=O)S1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC(C)(C)OC(=O)N1CC[C@H](NC2=CC=C(N)C=N2)C1.CC(C)(C)OC(N)=O as the reactants and reagents.",
"input": "",
"output": " CC(C)(C)OC(=O)N[C@H]1CCN(C2=CC=C(N)C=N2)C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC(C)(C)OC(=O)N1CC[C@H](NC2=CC=C(N)C=N2)C1.CC(C)(C)OC(N)=O is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC(C)(C)OC(=O)N[C@@H]1CCN(C2=CC=C(N)C=N2)C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CS(C)=O.O.O=C(CBr)OC1CCCCC1.O=S([O-])C1=CC=CC=C1.[Na+] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: O=C(CS(=O)(=O)C1=CC=CC=C1)OC1CCCCC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. C1=CC=NC=C1.CC(=O)Cl.COC1=CC=C(S/C=C\\C(C)O)C=C1.ClCCl ",
"input": "",
"output": " COC1=CC=C(S/C=C\\C(C)OC(C)=O)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C#CC(C)N1CCCC1.C1CCOC1.CC(=O)C1=CC=CC=C1.[Li]CCCC as the reactants and reagents.",
"input": "",
"output": " CC(C#CC(C)(O)C1=CC=CC=C1)N1CCCC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCOC(=N)CCl.C[C@@H](CO[Si](C)(C)C(C)(C)C)NC1=C(N)C=NC2=CC(Br)=CC=C12.Cl.ClC(Cl)Cl.ClCCCl.O=C([O-])O.[Na+] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " C[C@@H](CO[Si](C)(C)C(C)(C)C)N1C(CCl)=NC2=CN=C3C=C(Br)C=CC3=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with O=C(O)C1=CC2=CC=NC=C2CC1.[NH-]CCC1=CNC2=CC=CC=C12 as the reactants and reagents.",
"input": "",
"output": " O=C(NCCC1=CC=CC=C1)C1=CC2=CC=NC=C2CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " COC1=CC(C=CC=O)=CC=C1OCC1=C(C)OC(C2=CC=CO2)=N1.O=C1CSC(=O)N1 Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " COC1=CC(CCCC2SC(=O)NC2=O)=CC=C1OCC1=C(C)OC(C2=CC=CO2)=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1CCOC1.COC1=CC=C(CNC2=NC=CC=N2)C(OC)=C1.C[Si](C)(C)[N-][Si](C)(C)C.O=S(=O)(Cl)C1=CC(Cl)=C(F)C=C1F.[Li+] ",
"input": "",
"output": " COC1=CC=C(CN(C2=NC=CC=N2)S(=O)(=O)C2=CC(Cl)=C(F)C=C2F)C(OC)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CCOC(CCCl)OCC.C[N+](=O)[O-].Cl[Ti](Cl)(Cl)Cl.OCCC1=CC=CC(Cl)=C1 , what product could potentially be produced?",
"input": "",
"output": "The product can be ClCCC1OCCC2=CC(Cl)=CC=C21 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1CCOC1.CC(C)[Si](OC1=CC=C(N2N=C(C(C)(C)C)C=C2NC(=O)NC2=CC=C(OC3=CC=NC(NC(=O)N4CCOCC4)=C3)C3=CC=CC=C23)C=C1Cl)(C(C)C)C(C)C.CCCC[N+](CCCC)(CCCC)CCCC.CO.[F-] as the reactants and reagents.",
"input": "",
"output": " CC(C)(C)C1=NN(C2=CC=C(O)C(Cl)=C2)C(NC(=O)NC2=CC=C(OC3=CC=NC(NC(=O)N4CCOCC4)=C3)C3=CC=CC=C23)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC1(C)[C@@H](NC(=O)OCC2=CC=CC=C2)CC[C@@H]1O.CO.[Pd] ",
"input": "",
"output": " CC1(C)[C@@H](N)CC[C@@H]1O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC1=CC=CC=C1.CCOC(=O)N1CCN(C(=O)[C@H](CCC(=O)OC(C)(C)C)NC(=O)C2=NN(C3=CC=CC=C3)C(OC3(C(=O)OCC)CCC3)=C2)CC1.ClCCl.O=C(O)C(F)(F)F as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CCOC(=O)N1CCN(C(=O)[C@H](CCC(=O)O)NC(=O)C2=NN(C3=CC=CC=C3)C(OC3(C(=O)OCC)CCC3)=C2)CC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CCOC(=O)C1=C(C)NC(C=O)=C1CCC(=O)O.O=C1CC2=C(C=CC=C2C2CCNCC2)N1 .",
"input": "",
"output": " CCOC(=O)C1=C(C)NC(C=C2C(=O)NC3=CC=CC(C4CCNCC4)=C23)=C1CCC(=O)O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " BrCC1=CC=CC=C1.C1CCOC1.CCCCCC.CCOC(C)=O.CN1CCCN(C)C1=O.COC1=CC=C(S(=O)(=O)CCCS)C=C1.O.[Cl-].[Li]CCCC.[NH4+] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be COC1=CC=C(S(=O)(=O)C(CCO)CC2=CC=CC=C2)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C.C1=COCC1.CCOC(C)=O.COC1C=CC(CSC)(OC)O1.O.O=C1O[C@H]([C@@H](O)CO)C(O)=C1O ",
"input": "",
"output": " CSCC1=CC=C(C2(O)C(=O)OC(CC(O)O)C2=O)O1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC(=O)C1=CC=CC=C1C.CC1=CC=C(S(=O)(=O)O)C=C1.CC1=CC=CC=C1.CCOC(=O)NN.O ",
"input": "",
"output": " CCOC(=O)NN=C(C)C1=CC=CC=C1C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C=O.CC(=O)OC(C)=O.CC1=CC2=C(CCC(=O)N2)C2=C1CCCC2=O.CCCCNCC1=CC=CC=C1.Cl as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CCCCN(CC1=CC=CC=C1)CC1CCC2=C(C)C=C3NC(=O)CCC3=C2C1=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(=O)N[C@@H](C)C1=CC=C(C2CCN(C3=NC=C(C(=O)NC4=CC=CC=C4N)C=N3)CC2)C=C1.CC(=O)O Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CC(=O)N[C@@H](C)C1=CC=C(C2CCN(C3=NC=C(C4=NC5=CC=CC=C5N4)C=N3)CC2)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1COCCO1.COC1=NNC(=O)S1.O=C(CBr)C1CC1.O=C([O-])[O-].[K+] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be COC1=NN(CC(=O)C2CC2)C(=O)S1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC(C)(C)[C@H](N)CO.ClC1=CC=CC=C1.N#CC1=CC=C(C(=O)O)C=C1 ",
"input": "",
"output": " CC(C)(C)[C@H]1COC(C2=CC=C(C#N)C=C2)=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC#CCOC1=CC=C(C[C@H](NC(=O)[C@@H](/C=C/CCCCCCC(=O)CCCCCCC)[C@@](O)(CCO)C(=O)OC(C)(C)C)C(=O)N(C)C)C=C1.CC1=CC(C(C)(C)C)=NC(C(C)(C)C)=C1.C[O+](C)C.ClCCl.F[B-](F)(F)F ",
"input": "",
"output": " CC#CCOC1=CC=C(C[C@H](NC(=O)[C@@H](/C=C/CCCCCCC(=O)CCCCCCC)[C@@](O)(CCOC)C(=O)OC(C)(C)C)C(=O)N(C)C)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC(=O)O.CC(C)(C)OC(=O)OC(=O)OC(C)(C)C.CCN(CC)CC.COC1=NC=CC(I)=C1C1=NC2=C(C)N=C(N3CCN(C(=O)OC(C)(C)C)CC3)N=C2N1.Cl.O=C([O-])O.[Na+] .",
"input": "",
"output": " CC1=NC(N2CCN(C(=O)OC(C)(C)C)CC2)=NC2=C1N=C(C1=C(Cl)C=CNC1=O)N2 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC1=CC=C(N=[N+]=[N-])C=C1C(=O)C1=CC=C(NC2=CC=C(C(F)(F)F)C=C2)C=C1Cl.COC1=CC=C(NC2=CC=C(C(=O)C3=CC(N)=CC=C3C)C(Cl)=C2)C=C1 Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be COC1=CC=C(NC2=CC=C(C(=O)C3=CC(N=[N+]=[N-])=CC=C3C)C(Cl)=C2)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C1COCCO1.COC(=O)C1=CC=C(C2=NC(C)=CS2)C(C)=C1.O.[Li+].[OH-] , what product could potentially be produced?",
"input": "",
"output": "The product can be CC1=CSC(C2=CC=C(C(=O)O)C=C2C)=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC(C)=O.CCCOC(=O)C1=NC2=C(O)C(Cl)=CC=C2O1.CN(C)C=O.ClCC1=CC=C(OCC2=CC=C3C=CC=CC3=N2)C=C1.[I-].[K+] .",
"input": "",
"output": " CCCOC(=O)C1=NC2=C(OCC3=CC=C(OCC4=CC=C5C=CC=CC5=N4)C=C3)C(Cl)=CC=C2O1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC(Br)Br.CN(C)C=O.O.S=C1NC(C2=CC=CC=N2)=C(C2=CC=CC=N2)N1.[H-].[K+] ",
"input": "",
"output": " C1=CC=C(C2=C(C3=CC=CC=N3)N3CCSC3=N2)N=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CCO.CCOC(=O)CC(=O)CC(CC(=O)CC(=O)OCC)C1=CC=C(F)C(F)=C1.[Na+].[OH-] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: O=C(O)CC(CC(=O)O)C1=CC=C(F)C(F)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCCCC1.CCC.O=[N+]([O-])O Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be O=[N+]([O-])C1CCCCC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CCN(C(C)C)C(C)C.CCN=C=NCCCN(C)C.CN(C)C=O.COC(=O)CCCCC(=O)CN.COC1=CC=CC=C1C(=O)O.Cl.O.ON1N=NC2=CC=CC=C21 ",
"input": "",
"output": " COC(=O)CCCC(NC(=O)C1=CC=CC=C1OC)C(C)=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC1=CC=CC(C)=C1C(=O)O.N[C@@H]1CCC[C@@H]1N1CCCC1 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC1=CC=CC(C)=C1C(=O)N[C@@H]1CCC[C@@H]1N1CCCC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. C1=COC=C1.CON(C)C(=O)C1=CN(C2=CC=CC(C3=CC=CN=C3F)=C2)C=N1 ",
"input": "",
"output": " O=C(C1=CN(C2=CC=CC(C3=CC=CN=C3F)=C2)C=N1)C1=CC=CO1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.CC1=CC(F)=CC=C1Br.CCOC(=O)Cl.CCOCC.II.[MgH2] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CCOC(=O)C1=CC=C(F)C=C1C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC(C)(C)OC(=O)NCCN.CCOC(=O)C(C)(C)Br.CN(C)C=O.O=C([O-])[O-].[K+] , what product could potentially be produced?",
"input": "",
"output": "The product can be CCOC(=O)C(C)(C)NCCNC(=O)OC(C)(C)C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CCN(CC)CC.CCO.CNN.O=C1C=COC2=CC=C(Cl)C=C12.O=S(=O)(O)O as the reactants and reagents.",
"input": "",
"output": " CN1N=CC=C1C1=CC(Cl)=CC=C1O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC1=C(F)C=C(C(=O)NC2CC2)C=C1C1=CC=C2C(=O)N(CC3CC3)C=C(C=O)C2=C1.OCC1CCNCCN1 Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CC1=C(F)C=C(C(=O)NC2CC2)C=C1C1=CC=C2C(=O)N(CC3CC3)C=C(CN3CCNC(CO)CC3)C2=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with Br[Mg]C1=CC=CC=C1.C1CCOC1.CCOC(=O)C1=C(C2=CC=C(C=O)C=C2)C(C#N)=C(CC)N1C.O as the reactants and reagents.",
"input": "",
"output": " CCOC(=O)C1=C(C2=CC=C(C(O)C3=CC=CC=C3)C=C2)C(C#N)=C(CC)N1C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC1=CC=CC(C(=O)N=C=S)=C1.CC1=CC=CC=C1.CCO.COC1=CC2=NC=CC(OC3=CC=C(N)C(F)=C3)=C2C=C1OC , what product could potentially be produced?",
"input": "",
"output": "The product can be COC1=CC2=NC=CC(OC3=CC=C(NC(=S)NC(=O)C4=CC=CC(C)=C4)C(F)=C3)=C2C=C1OC .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C1CCOC1.COC(=O)C1=CC2=NC=NC(NCCC3=CC=C(NC(=O)C4=CC=CC(C(F)(F)F)=C4)C=C3)=C2S1.[Li+].[OH-] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: O=C(NC1=CC=C(CCNC2=NC=NC3=C2SC(C(=O)O)=C3)C=C1)C1=CC=CC(C(F)(F)F)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " BrCC1=CC=CC(Br)=N1.CC1=CC=C(C(=O)C2=CNC3=CC=CN=C3C2=O)C=C1C.CN(C)C=O.O.[H-].[Na+] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CC1=CC=C(C(=O)C2=CN(CC3=CC=CC(Br)=N3)C3=CC=CN=C3C2=O)C=C1C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CN1C=NN=C1S.ClC1=NC=NC2=CC=C(I)C=C12.NC1=NC=CS1 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CN1C=NN=C1SC1=CC=C2N=CN=C(NC3=NC=CS3)C2=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)(C)OC(=O)NC1CCN(C2CCN(C3=NC=NC(Cl)=N3)CC2)C1.CC1(C)CCC(C)(C)C2=CC(B3OC(C)(C)C(C)(C)O3)=CC=C21.CN(C)C=O.CO.COCCOC.Cl[Pd](Cl)([PH](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1)[PH](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1.O.O=C([O-])[O-].[Na+] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CC(C)(C)OC(=O)NC1CCN(C2CCN(C3=NC=NC(C4=CC=C5C(=C4)C(C)(C)CCC5(C)C)=N3)CC2)C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.CCOC(=O)CS.CCOCC.C[Mg]Br.Cl.N#CC1=NC=CC=C1Cl.O.O=C([O-])[O-].[K+] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CCOC(=O)C1=C(C)C2=NC=CC=C2S1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CCN(CC)CC.CN1C=C(CO)C(C(F)(F)F)=N1.CS(C)=O.ClCCl.O=C(Cl)C(=O)Cl ",
"input": "",
"output": " CN1C=C(C=O)C(C(F)(F)F)=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CCN=C=NCCCN(C)C.CN.Cl.ClCCl.O=C(O)CCCC1OCCCO1.OC1=CC=CC2=C1N=NN2 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CNC(=O)CCCC1OCCCO1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C1CCOC1.CC1=CC(Br)=CC(C)=C1NC(=O)C(C)Br.N#CCC#N.[Cl-].[H-].[NH4+].[Na+] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CC1=CC(Br)=CC(C)=C1N1C(=O)C(C)C(C#N)=C1N ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC1(C)NN(C2C3CC4CC(C3)CC2C4)C1=O.FC1=CC=CC(CBr)=C1F .",
"input": "",
"output": " CC1(C)C(=O)N(C2C3CC4CC(C3)CC2C4)N1CC1=CC=CC(F)=C1F ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CO.COC1=CC=C(C(C)=O)C=C1.C[O-].Cl.O=CC1=CC=CO1.[Na+] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be COC1=CC=C(C(=O)C=CC2=CC=CO2)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CCN(C(C)C)C(C)C.CCOC(C)=O.CN1CCCC1=O.C[Si](C)(C)CCOCN1C(C2=CC=CN=C2)=CC2=C(Cl)C=CN=C21.O=[N+]([O-])C1=CC=C(O)C(F)=C1 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " C[Si](C)(C)CCOCN1C(C2=CC=CN=C2)=CC2=C(OC3=CC=C(N)C=C3F)C=CN=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCCCN1C(=O)C2=CC=CN=C2C1(O)C1=CC=CC=C1.O.O=S(=O)(O)O.O=[N+]([O-])O Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CCCCN1C(=O)C2=CC=CN=C2C1(O)C1=CC=CC([N+](=O)[O-])=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: FC(F)(F)C1=CC(Cl)=NC(C2=CC=CC=N2)=N1.NC1=CC(O)=CC=C1Cl , what product could potentially be produced?",
"input": "",
"output": "The product can be OC1=CC=C(Cl)C(NC2=CC(C(F)(F)F)=NC(C3=CC=CC=N3)=N2)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C1COCCO1.CC(=O)[O-].CC(C)(C)[O-].CC(C)C1=CC(C(C)C)=C(C2=CC=CC=C2P(C2CCCCC2)C2CCCCC2)C(C(C)C)=C1.CC(N)CO[Si](C)(C)C.FC1=CC=C(N2N=CN=C2C2=CC3=C(S2)C2=NC(Cl)=CC=C2OCC3)C(F)=C1.[Na+].[Pd+2] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CC(CO)NC1=CC=C2OCCC3=C(SC(C4=NC=NN4C4=CC=C(F)C=C4F)=C3)C2=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CCOC(=O)C1=C(N)SC2=C1CCCC2.CCOC(=O)C1=C(NS(=O)(=O)C2=CC=CC=C2C(F)(F)F)SC2=C1CCCC2.O=S(=O)(Cl)C1=CC=CC=C1Br ",
"input": "",
"output": " CCOC(=O)C1=C(NS(=O)(=O)C2=CC=CC=C2Br)SC2=C1CCCC2 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC1=CC2=C(C=C1O)C(=O)C1=CC=CC=C1O2.CCOC(=O)CBr.CN(C)C=O.Cl.O.O=C([O-])[O-].[K+].[Na+].[OH-] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC1=CC2=C(C=C1OCC(=O)O)C(=O)C1=CC=CC=C1O2 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC#N.COC1=NN=C(C2=CC(C)=C(O)C(C)=C2)C=C1C1=CC2=CC=CC=C2N1.C[Si](C)(C)Cl.O.[I-].[K+] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC1=CC(C2=NNC(=O)C(C3=CC4=CC=CC=C4N3)=C2)=CC(C)=C1O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CCOC(=O)NC(C)C(=O)C1=CC=C(O)C(Cl)=C1.CN(C)C=O.COC1=CC=C(CCNC(=O)CCl)C=C1OC.[H-].[Na+] as the reactants and reagents.",
"input": "",
"output": " CCOC(=O)NC(C)C(=O)C1=CC=C(OCC(=O)NCCC2=CC=C(OC)C(OC)=C2)C(Cl)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC1=CC=C(S(=O)(=O)O)C=C1.CCO.CCOC(OCC)OCC.COC1=CC=C2C(=C1)OC1=C(C=CC(OC)=C1C=O)C2(C)C.O ",
"input": "",
"output": " COC1=CC=C2C(=C1)OC1=C(C=CC(OC)=C1C(OC)OC)C2(C)C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1CCOC1.COC1=C(C)C(=O)OC1=O.Cl.[BH4-].[Na+] as the reactants and reagents.",
"input": "",
"output": " COC1=C(C)C(=O)OC1O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) COC1=CC=C2C=CC(S(=O)(=O)N[C@H]3CCN(CC4=CC=CC(C#N)=C4)C3=O)=CC2=C1.ClCC1=CC=CC=N1 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: COC1=CC=C2C=CC(S(=O)(=O)N(CC3=CC=CC=N3)[C@H]3CCN(CC4=CC=CC(C#N)=C4)C3=O)=CC2=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.C=CCN(C(=O)C1=CC(O)=CC(Cl)=C1)C1CCCC1.CCOC(=O)N=NC(=O)OCC.OCCCO Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be C=CCN(C(=O)C1=CC(Cl)=CC(OCCCO)=C1)C1CCCC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C1CCOC1.CC(C)NC(C)C.CCCCCC.ClC1=CC=NC(Cl)=N1.O=C(O)CC(O)(CC(=O)O)C(=O)O.O=CC1=CC=CC=N1.[Li]CCCC .",
"input": "",
"output": " OC(C1=CC=CC=N1)C1=CN=C(Cl)N=C1Cl ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.C=CCBr.CC(C)(C)OC(=O)N(C(=O)OC(C)(C)C)C1=N[C@](C)(C2=CC([N+](=O)[O-])=CC=C2F)CS(=O)(=O)C1(C)C.C[Si](C)(C)[N-][Si](C)(C)C.[Cl-].[K+].[NH4+] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " C=CCC1[C@@](C)(C2=CC([N+](=O)[O-])=CC=C2F)N=C(N(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C)C(C)(C)S1(=O)=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C1=CC=C(P(C2=CC=CC=C2)[C-]2C=CC=C2)C=C1.C1COCCO1.CC(=O)[O-].CC(C)(C)OC(=O)N1CC(O)(C2=CC(C#N)=CC(N)=C2Cl)C1.COC1=CC=C(CN(C2=NC(Cl)=NN3C(C#N)=CN=C23)C2CC2)C=C1.O=C([O-])[O-].[Cs+].[Fe+2].[Pd+2] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: COC1=CC=C(CN(C2=NC(NC3=CC(C#N)=CC(C4(O)CN(C(=O)OC(C)(C)C)C4)=C3Cl)=NN3C(C#N)=CN=C23)C2CC2)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " COC(=O)CC(=O)C[C@@](O)(CCC1=CC=CC=C1)C1=CC=CC=C1.[Na+].[OH-] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be O=C1C=C(O)C[C@@](CCC2=CC=CC=C2)(C2=CC=CC=C2)O1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC(C)C(=O)C(=[N+]=[N-])P(=O)([O-])[O-].CO.O=C([O-])[O-].O=CC1(COCC2=CC=CC=C2)CCC2(CC1)OCCO2.[K+] , what product could potentially be produced?",
"input": "",
"output": "The product can be C#CC1(COCC2=CC=CC=C2)CCC2(CC1)OCCO2 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)(C)C(=O)SCCl.CCP(=O)(O)C1=CC(OC2=NC=C(C(F)(F)F)C=C2Cl)=CC=C1[N+](=O)[O-] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CCP(=O)(OCSC(=O)C(C)(C)C)C1=CC(OC2=NC=C(C(F)(F)F)C=C2Cl)=CC=C1[N+](=O)[O-] .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCCC[N+](CCCC)(CCCC)CCCC.ClCCl.NC1=CC=CC=C1O.O.O=C(CBr)C1=CC=CC=C1.O=C([O-])[O-].O=S(=O)([O-])O.[K+] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be C1=CC=C(C2=NC3=CC=CC=C3OC2)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCO.CI.NC(=S)NC1=CC=CC(F)=C1 Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CSC(=N)NC1=CC=CC(F)=C1.I ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CCO.CCOC(=O)C(=O)C1=CC(CSC2=CC=CC(Cl)=C2)=C(C(=O)OCC)N1C.Cl.[Na+].[OH-] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CN1C(C(=O)C(=O)O)=CC(CSC2=CC=CC(Cl)=C2)=C1C(=O)O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CO.Cl.ClCCl.O.O=C1C[C@@H]2[C@@H](/C=C/C(=O)C3CCCCC3)[C@H](OC(=O)C3=CC=CC=C3)C[C@@H]2O1.[BH4-].[Ce+3].[Cl-].[Na+] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: O=C1CC2C(CC(OC(=O)C3=CC=CC=C3)C2/C=C/[C@H](O)C2CCCCC2)O1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C1CCOC1.CC(C)(C)OC(=O)N1CCN(C2=NC=C(Br)C=N2)CC1.CON(C)C(=O)C1=CC=C(F)C=C1.[Li]CCCC as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CC(C)(C)OC(=O)N1CCN(C2=NC=C(C(=O)C3=CC=C(F)C=C3)C=N2)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CN(C)C=O.O.O=[N+]([O-])C1=CC(C2=NC=C(C(F)(F)F)C=C2Cl)=CC=C1F.[C-]#N.[K+] .",
"input": "",
"output": " N#CC1=CC=C(C2=NC=C(C(F)(F)F)C=C2Cl)C=C1[N+](=O)[O-] ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CN(C)CC(C1=CC=C(O)C=C1)C1(O)CCCCC1.COC1=CC=C(CC#N)C=C1.O=C1CCCCC1.[Na+].[OH-] .",
"input": "",
"output": " COC1=CC=C(CC2CCCCC2(O)C#N)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CCO.CSC1=NC=C2CN(C3=CC=CC(C(=O)NC4=CC=CC(C(F)(F)F)=C4)=C3)CCC2=N1.[Ni] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: O=C(NC1=CC=CC(C(F)(F)F)=C1)C1=CC=CC(N2CCC3=NC=NC=C3C2)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C1=CC=NC=C1.CC1=CC=CC=C1.CCC(C)(C)C1=CC=C(OCC(=O)NC2=CC=CC(C(=O)NC3=C(O)C(=O)N(C4=C(Cl)C=C(Cl)C=C4Cl)N3)=C2)C(C(C)(C)CC)=C1.CCCCCC.O=C=NC1=CC=CC=C1 , what product could potentially be produced?",
"input": "",
"output": "The product can be CCC(C)(C)C1=CC=C(OCC(=O)NC2=CC=CC(C(=O)NC3=C(OC(=O)NC4=CC=CC=C4)C(=O)N(C4=C(Cl)C=C(Cl)C=C4Cl)N3)=C2)C(C(C)(C)CC)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC(C)(OC1=CC=CC(NCCC2=CC=C(C(F)(F)F)C=C2)=C1)C(=O)O.CCN(CC)CC.CCN=C=NCCCN(C)C.ClCCl.NC1=NC=C(Cl)S1.ON1N=NC2=CC=CC=C21 ",
"input": "",
"output": " CC(C)(OC1=CC=CC(NCCC2=CC=C(C(F)(F)F)C=C2)=C1)C(=O)NC1=NC=C(Cl)S1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " COC(=O)C1=C(Br)N=C(N2C=NC3=CC(OC)=C(OC)C=C32)S1.OB(O)C1=CC=C(Cl)C(Cl)=C1 Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be COC1=CC2=C(C=C1OC)N(C1=NC(C3=CC=C(Cl)C(Cl)=C3)=C(C(=O)O)S1)C=N2 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1=CC=C([PH](C2=CC=CC=C2)(C2=CC=CC=C2)[Pd]([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)[PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.C1CCOC1.COC1=CC(CC(=O)NC2=CC=CC(I)=C2)=CC=C1O.O.O=C([O-])[O-].OB(O)C1=CC=CC=C1.[Cs+] ",
"input": "",
"output": " COC1=CC(CC(=O)NC2=CC=CC(C3=CC=CC=C3)=C2)=CC=C1O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCC(N)(CC)C(=O)NC.O=C(O)C1=CC=C(N(CC(F)(F)F)CC(F)(F)F)C(OCC2CC2)=N1 Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CCC(CC)(NC(=O)C1=CC=C(N(CC(F)(F)F)CC(F)(F)F)C(OCC2CC2)=N1)C(=O)NC .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC1=CC=C(C[C@@H](NC(=O)OCC2C3=CC=CC=C3C3=CC=CC=C32)C(=O)O)C=C1.CCN(CC)CC.CCOCC.CN(C)C(ON1N=NC2=CC=CC=C21)=[N+](C)C.CO.F[B-](F)(F)F ",
"input": "",
"output": " COC(=O)[C@@H](CC1=CC=C(C)C=C1)NC(=O)OCC1C2=CC=CC=C2C2=CC=CC=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C1CNCCN1.C1COCCO1.CC(=O)N(C)C.Cl.O=S(=O)(C1=CC=C(F)C(F)=C1)C1CCC1 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: O=S(=O)(C1=CC=C(N2CCNCC2)C(F)=C1)C1CCC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CN1C=CN=C1SC1=CC=C(N/C=C2\\C(=O)NC(=O)C3=CC=CC=C23)C=C1Cl.CO/C=C1/C(=O)NC(=O)C2=CC=C([N+](=O)[O-])C=C12.NC1=CC=C(CN2CCCCC2)C=C1 ",
"input": "",
"output": " O=C1NC(=O)C2=CC=C([N+](=O)[O-])C=C2/C1=C/NC1=CC=C(CN2CCCCC2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: BrC1=CC=C2C=CNC2=C1.CC1=CC=CC=C1B(O)O .",
"input": "",
"output": " CC1=CC=CC=C1C1=CC=C2C=CNC2=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)(C)OC(=O)C(C)(C)N.CCN(CC)CC.CCOC(C)=O.CN(C)C=O.Cl.O=[N+]([O-])C1=CC=CC=C1F Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CC(C)(C)OC(=O)C(C)(C)NC1=CC=CC=C1[N+](=O)[O-] .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: Cl.ClCCl.Cl[Fe](Cl)Cl.O=C(NCC1=CC=C(Cl)C(Cl)=C1)C1=C(OCC2=CC=CC=C2)C(=O)N2OC3=CC=CC(N4CCOCC4)=C3C2=N1 .",
"input": "",
"output": " O=C(NCC1=CC=C(Cl)C(Cl)=C1)C1=C(O)C(=O)N2OC3=CC=CC(N4CCOCC4)=C3C2=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CCOC(C)=O.CO.COC1=CC=CC=C1C#CC1=CC=NC(NC(=O)OC(C)(C)C)=C1.[Pd] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: COC1=CC=CC=C1CCC1=CC=NC(NC(=O)OC(C)(C)C)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CC1=CC(NC2=NC=CC(C(F)(F)F)=N2)=CC(C2=CN=C([C@@]3(O)CC[C@H](C(=O)O)C(C)(C)C3)S2)=C1.ClC(Cl)Cl.NC(=O)CCC(=O)NBr as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CC1=CC(NC2=NC=CC(C(F)(F)F)=N2)=CC(C2=CN=C([C@@]3(O)CC[C@H](C(=O)O)C(C)(C)C3)S2)=C1Br .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CCN(CC)CC.CCOC(=O)Cl.Cl.ClCCl.O=C(NC1CCCCC1)C1=CC=C(S(=O)(=O)NC2CCNCC2)C2=CC=CC=C12 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CCOC(=O)N1CCC(NS(=O)(=O)C2=CC=C(C(=O)NC3CCCCC3)C3=CC=CC=C23)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CSC1=NC(SCC2=CC=CC=C2)=NN1.ClC1=NC=CC=N1 Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CSC1=NC(SCC2=CC=CC=C2)=NN1C1=NC=CC=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C1=CC=C(CO[C@H]2[C@@H]3O[C@@H]3[C@@H]3OC[C@H]2O3)C=C1.CCO.[Br-] .",
"input": "",
"output": " O[C@@H]1[C@@H](O)[C@@H]2OC[C@@H](O2)[C@H]1OCC1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC(C)C[Al+]CC(C)C.CC1=CC=CC=C1.N#CC1=C2CCCN2C=C1.O=C(O)CC(O)(CC(=O)O)C(=O)O.[H-] .",
"input": "",
"output": " O=CC1=C2CCCN2C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1=CC=C(COC2=CC=C(OCCN3N=C4C=CC=CC4=N3)C=C2)C=C1.CC1=CC=CC=C1.[H][H] ",
"input": "",
"output": " OC1=CC=C(OCCN2N=C3CCCCC3=N2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC(C[N+](=O)[O-])C1=CC=CN=C1.CCO.Cl.[Pd] ",
"input": "",
"output": " CC(CN)C1=CC=CN=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C(=NC1CCCCC1)=NC1CCCCC1.CC(C)(C)OC(=O)NC[C@H](NC(=O)OCC1=CC=CC=C1)C(=O)O.CC(O)[Si](C)(C)C.CN(C)C1=CC=NC=C1.ClCCl ",
"input": "",
"output": " CC(C)(C)OC(=O)NC[C@H](NC(=O)OCC1=CC=CC=C1)C(=O)OCC[Si](C)(C)C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CCO.NC1=C(N)N(CC2CCCCC2)C(=S)N(CC2CCCCC2)C1=O.NC1=C(N=O)C(=O)N(CC2CCCCC2)C(=S)N1CC1CCCCC1.O=CC1=CC=C(C=CC(=O)O)C=C1 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: O=C(O)/C=C/C1=CC=C(C2=NC3=C(N2)N(CC2CCCCC2)C(=S)N(CC2CCCCC2)C3=O)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C1=CC=C([PH](C2=CC=CC=C2)(C2=CC=CC=C2)[Pd]([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)[PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.C1COCCO1.COC1=CC(B2OC(C)(C)C(C)(C)O2)=CC=C1OCCN1CCCC1.NC1=NC=C(I)C=C1Br.O.O=C([O-])O.O=C([O-])[O-].[K+].[Na+] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " COC1=CC(C2=CN=C(N)C(Br)=C2)=CC=C1OCCN1CCCC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CN(C)C1(C2=CC=C3OCOC3=C2)CCC2(CC1)OCCO2.Cl Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CN(C)C1(C2=CC=C3OCOC3=C2)CCC(=O)CC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1CCNCC1.CCO.CNS(=O)(=O)C1=CC=C2NC(=O)CC2=C1.COC1=CC=CC2=C1C=C(C=O)N2 ",
"input": "",
"output": " CNS(=O)(=O)C1=CC=C2NC(=O)C(=CC3=CC4=C(OC)C=CC=C4N3)C2=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " N.NN1CC=C(C2=CC=CC=C2)CC1.O=C(OC[C@H]1O[C@@H](N2C=NC3=C(Cl)N=C(Cl)N=C32)[C@H](OC(=O)C2=CC=CC=C2)[C@@H]1OC(=O)C1=CC=CC=C1)C1=CC=CC=C1 Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be OC[C@H]1O[C@@H](N2C=NC3=C(NN4CC=C(C5=CC=CC=C5)CC4)N=C(Cl)N=C32)[C@H](O)[C@@H]1O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC(C)(C)OC(=O)N[C@H](C(=O)N1C[C@@H](F)C[C@H]1C#N)C(C)(C)SCC1=CC=CC(OC2=CC=CC=C2)=C1.ClCCl.O=C(O)C(F)(F)F.O=C([O-])O.[Na+] ",
"input": "",
"output": " CC(C)(SCC1=CC=CC(OC2=CC=CC=C2)=C1)[C@H](N)C(=O)N1C[C@@H](F)C[C@H]1C#N.Cl ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C=C=C(CC(O)CC1CCCCCC1=O)C[Si](C)(C)C.CCOC(C)=O.CCOCC.C[Si](C)(C)OS(=O)(=O)C(F)(F)F.O as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: C=C1CC2CC3CCCCCC3(O2)C1=C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C=C(C(C(=O)OCC)C1=CC=C(Cl)C=C1)C(F)(F)F.CCOC(=O)C(C1=CC=C(Cl)C=C1)C(C)C(F)(F)F as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CC(C(C(=O)O)C1=CC=C(Cl)C=C1)C(F)(F)F .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses B.C1CCOC1.CC(=O)O[C@@H]1[C@@H](OC(C)=O)[C@H](OC(C)=O)C2(CC2)O[C@H]1C1=CC=C(Cl)C(CC2=CC=C3OCC(=O)NC3=C2)=C1 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CC(=O)O[C@@H]1[C@@H](OC(C)=O)[C@H](OC(C)=O)C2(CC2)O[C@H]1C1=CC=C(Cl)C(CC2=CC=C3OCCNC3=C2)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C=CCCCCCC.CC(=O)O[Si](C)(OC(C)=O)OC(C)=O.CC1=CC=CC=C1.CCO[SiH](OCC)OCC Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CCCCCCCC[Si](OCC)(OCC)OCC .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1CCOC1.CC(C)[Mg]Cl.CCOC(=O)C1=CC(OCC)=CC(S(F)(F)(F)(F)F)=C1.CNOC.Cl as the reactants and reagents.",
"input": "",
"output": " CCOC1=CC(C(=O)N(C)OC)=CC(S(F)(F)(F)(F)F)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC(C)(C)OC(=O)N1CCCC(=O)C1.NC1=CC=NC=C1 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " C1=CC(NC2CCCNC2)=CC=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C1=CC=C([PH](C2=CC=CC=C2)(C2=CC=CC=C2)[Pd]([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)[PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.COC(=O)CCNC(=O)C1=CC=C(C(CC(C)(C)C)OC2=CN=C(Cl)C(C)=C2)C=C1.OB(O)C1=CC=C(OC(F)(F)F)C=C1.[F-].[K+] , what product could potentially be produced?",
"input": "",
"output": "The product can be COC(=O)CCNC(=O)C1=CC=C(C(CC(C)(C)C)OC2=CN=C(C3=CC=C(OC(F)(F)F)C=C3)C(C)=C2)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with ClC1(Cl)COCCO1.NC1=CC=C(C(=O)C2=CC=CC=C2)C=C1 as the reactants and reagents.",
"input": "",
"output": " O=C(COCCCl)NC1=CC=C(C(=O)C2=CC=CC=C2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C1CCOC1.C[C@@H](O[C@H]1CC[C@@H]2CN(C3=CC(=O)CC3)C[C@H]2[C@@H]1C1=CC=C(F)C=C1)C1=CC(C(F)(F)F)=CC(C(F)(F)F)=C1.C[Si](C)(C)[N-][Si](C)(C)C.[K+] , what product could potentially be produced?",
"input": "",
"output": "The product can be C[C@@H](O[C@H]1CC[C@@H]2CN(C3=CC(=O)C(O)C3)C[C@H]2[C@@H]1C1=CC=C(F)C=C1)C1=CC(C(F)(F)F)=CC(C(F)(F)F)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) COCC(OC)OC.NC1=CC=C2N=CN=C(NC3=CC=C(F)C=C3F)C2=C1 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: COCCNC1=CC=C2N=CN=C(NC3=CC=C(F)C=C3F)C2=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CC(C)(C)OC(=O)NC1=CC(N2CCCC2)=C(Cl)C=C1NC(=O)CC(=O)C1=CC=CC(N2N=NC=C2COC2CCCCO2)=C1.ClCCl.O=C(O)C(F)(F)F as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: O=C1CC(C2=CC=CC(N3N=NC=C3CO)=C2)=NC2=CC(N3CCCC3)=C(Cl)C=C2N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CO.Cl[Ni]Cl.N#CCCC1(COCC2=CC(C(F)(F)F)=CC(C(F)(F)F)=C2)OCC2=CC=CC=C21.O.[BH4-].[Na+] ",
"input": "",
"output": " NCCCC1(COCC2=CC(C(F)(F)F)=CC(C(F)(F)F)=C2)OCC2=CC=CC=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1=CC=NC=C1.COC1=CC=C(S(=O)(=O)Cl)C=C1.O=[N+]([O-])C1=CC(Br)=CC2=C1NCC2 ",
"input": "",
"output": " COC1=CC=C(S(=O)(=O)N2CCC3=CC(Br)=CC([N+](=O)[O-])=C32)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C1COCCO1.CO.C[C@H](NC1=NC=NC2=C1N=CN2C1CCCCO1)C1=NC2=CC=C(F)C(Br)=C2N1C1=CC=CC=C1.Cl as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " C[C@H](NC1=NC=NC2=C1N=CN2)C1=NC2=CC=C(F)C(Br)=C2N1C1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CN(C)C1=CC=CC(CCl)=N1.COC1=CC=C(N(CC2=CNN=C2)C(=O)C2CCCC3=C(OCC4=CC=CC=C4)C=CC=C32)C=N1 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: COC1=CC=C(N(CC2=CN(CC3=CC=CC(N(C)C)=N3)N=C2)C(=O)C2CCCC3=C(OCC4=CC=CC=C4)C=CC=C32)C=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1CCOC1.CC(C)(C)[Si](OC[C@@H](CCl)NS(C)(=O)=O)(C1=CC=CC=C1)C1=CC=CC=C1.CC(C)[N-]C(C)C.Cl.[Li+] as the reactants and reagents.",
"input": "",
"output": " CC(C)(C)[Si](OC[C@H]1CCS(=O)(=O)N1)(C1=CC=CC=C1)C1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " O.O=NC1=C(O)C=CC2=CC(Br)=CC=C12.O=S([O-])O.[Na+].[OH-] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be NC1=C(O)C=C(S(=O)(=O)O)C2=CC(Br)=CC=C12 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CCO.CCOC(C)=O.CCOC(OCC)OCC.NC1=CC=C2C=CN3C=CC=C3C(=O)C2=C1.[BH4-].[Na+] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CNC1=CC=C2C=CN3C=CC=C3C(=O)C2=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCCCCC.CCOC(C)=O.ClCCl.NC1=CC(C(F)(F)F)=CC=N1.O=C(CC1=CC=NC(Cl)=N1)C1=CC=CC(C(=O)NC2=C(F)C=CC=C2F)=C1.O=C([O-])O.O=C1CCC(=O)N1Br.[Na+] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be O=C(NC1=C(F)C=CC=C1F)C1=CC=CC(C2=C(C3=CC=NC(Cl)=N3)N3C=CC(C(F)(F)F)=CC3=N2)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C1=CC=CC=C1.CC(Br)C(=O)Cl.CC1=CC=C(C)C(NCC=O)=C1C.O.O=C([O-])[O-].[Na+] , what product could potentially be produced?",
"input": "",
"output": "The product can be CC1=CC=C(C)C(N(CC=O)C(=O)C(C)Br)=C1C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C1CCOC1.CC1=CC2=C(C=C1C)NC(SCC1=CC=CC=C1C#N)=N2.ClCC1=CC(Cl)=CC=C1Cl.O.[H-].[Na+] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CC1=CC=C(C)C(CN2C(SCC3=CC=CC=C3C#N)=NC3=CC(C)=C(C)C=C32)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " BrCC1=CC=CC=C1Br.CN1C(=O)C=C(N2CCC[C@@H](N)C2)N(CC2=CC=CC=C2C#N)C1=O.N#CC1=CC=CC=C1CN1C(Cl)=CC(=O)NC1=O Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be N[C@@H]1CCCN(C2=CC(=O)NC(=O)N2CC2=CC=CC=C2Br)C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CN(C)C=O.COC(=O)C1=CC2=C(C3=CC=NC(F)=C3)N=CC=C2N1.ClC1=CC=C(OCCBr)C=C1.O.[H-].[Na+] ",
"input": "",
"output": " COC(=O)C1=CC2=C(C3=CC=NC(F)=C3)N=CC=C2N1CCOC1=CC=C(Cl)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. BrC1=C(C2=NN=CN2)SC=C1.CC(=O)O.II.O.O=S(=O)(O)O.[O-][I+3]([O-])([O-])O ",
"input": "",
"output": " BrC1=C(C2=NN=CN2)SC(I)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C1CCOC1.CC(C)(C)[O-].CCOC1=CC=C(C2=CC=C(C=O)[Se]2)C(F)=C1F.COC(C)(C)C.C[P+](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1.Cl.O.[Br-].[K+] .",
"input": "",
"output": " C=CC1=CC=C(C2=CC=C(OCC)C(F)=C2F)[Se]1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. BrB(Br)Br.C1=CCCCC1.COC1=CC=C(C2=NN(C(C)C)C3=C(F)C=CC=C23)C(C)=C1 ",
"input": "",
"output": " CC1=CC(O)=CC=C1C1=NN(C(C)C)C2=C(F)C=CC=C12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C1=CC=NC=C1.CCN=C=NCCCN(C)C.CNC1=CC=C2C=C(C3=NNC4=C3CCC(C)(C)C4)NC2=C1.C[C@@H](C(=O)O)N1CCOCC1.Cl.ClC(Cl)Cl.O , what product could potentially be produced?",
"input": "",
"output": "The product can be C[C@@H](C(=O)N(C)C1=CC=C2C=C(C3=NNC4=C3CCC(C)(C)C4)NC2=C1)N1CCOCC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C1CCNCC1.CC(=O)O.CC(C)NC1=CC=CC=C1C=O.CC1=CC=CC=C1.CCOC(=O)CC(=O)OCC , what product could potentially be produced?",
"input": "",
"output": "The product can be CCOC(=O)C1=CC2=CC=CC=C2N(C(C)C)C1=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C1CCOC1.COC1=CC=C2OC(C3=CC=CC=C3)C(=O)NC2=C1.O.[Al+3].[H-].[Li+].[Na+].[OH-] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " COC1=CC=C2OC(C3=CC=CC=C3)CNC2=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1CCOC1.CC(C)[N-]C(C)C.CC=O.O=C1OCC2=CC=CC=C12.[Li+] ",
"input": "",
"output": " CC(O)C1OC(=O)C2=CC=CC=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CCC1=NC(C2=CC=C(OC)C=C2Cl)=C(CC)N=C1N[C@H]1COC[C@H]1O.CCCI.CCO[C@H]1CC2=CC=CC=C2[C@H]1NC1=NC(CC)=C(C2=CC=C(Cl)C=C2Cl)N=C1CC is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CCCO[C@H]1COC[C@H]1NC1=NC(CC)=C(C2=CC=C(OC)C=C2Cl)N=C1CC ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CCCCN(C=NC1=NC(N=CN(CCCC)CCCC)=C2C=NN([C@H]3C[C@H](O)[C@@H](CO)O3)C2=N1)CCCC.CCCCN(CCCC)C(OC)OC.CO.NC1=NC(N)=C2C(Br)=NN([C@H]3C[C@H](O)[C@@H](CO)O3)C2=N1 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CCCCN(C=NC1=NC(N=CN(CCCC)CCCC)=C2C(Br)=NN([C@H]3C[C@H](O)[C@@H](CO)O3)C2=N1)CCCC ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CN(C)C=O.NC(=S)NC1CCCCC1.O=CC(Br)C1=CC=C2C(=O)NC=NC2=C1 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " O=C1NC=NC2=CC(C3=CN=C(NC4CCCCC4)S3)=CC=C12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CCO.CSC(NC1=CC=CC=C1)=C(C#N)C#N.NN.O , what product could potentially be produced?",
"input": "",
"output": "The product can be N#CC1=C(N)NN=C1NC1=CC=CC=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC(O)CO.CCCC[Sn](=O)O.COC(=O)C1=CC=C(C(=O)OC)C=C1.COC(=O)C1=CC=CC(C(=O)OC)=C1S(=O)(=O)O.O=C([O-])C1=CC=C(C(=O)[O-])C=C1.O=C([O-])C1=CC=CC(C(=O)[O-])=C1S(=O)(=O)O.OCCOCCO.[Na+].[NaH] ",
"input": "",
"output": " CC1CCC(C)OC(=O)C2=CC=C(C=C2)C(=O)OC(C)C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C.CO.COC(=O)C1=CC=C(C2=CC=CC=C2)C=C1NC(=O)C1=CC(C2CCN(C)CC2)=CC=C1OCC1=CC=CC=C1.[Pd] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: COC(=O)C1=CC=C(C2=CC=CC=C2)C=C1NC(=O)C1=CC(C2CCN(C)CC2)=CC=C1O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC1=CC=C(C)C(CCl)=C1.CCCCN1C(=O)C2C(=O)NC(=O)C(C1=O)C2(C)C.CN(C)C=O.O=C([O-])[O-].[K+] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CCCCN1C(=O)C2C(=O)N(CC3=CC(C)=CC=C3C)C(=O)C(C1=O)C2(C)C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CCC1=NN(CC(=O)NN)C(CC)=C1OC1=CC(Cl)=CC(Cl)=C1.CCO.N#CBr .",
"input": "",
"output": " CCC1=NN(CC2=NN=C(N)O2)C(CC)=C1OC1=CC(Cl)=CC(Cl)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. C1COCCO1.CC1=CC=C(S(=O)(=O)OC(=CC(C)C)C2=CC3=CC=CN=C3N2S(=O)(=O)C2=CC=CC=C2)C=C1.CCOC(C)=O.Cl[Pd](Cl)([PH](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1)[PH](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1.O=C([O-])[O-].OB(O)C1=CC=CC(F)=C1.[Na+] ",
"input": "",
"output": " CC(C)C=C(C1=CC=CC(F)=C1)C1=CC2=CC=CN=C2N1S(=O)(=O)C1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC1(C)OCC(CO)O1.CN(C)P(=O)(N(C)C)N(C)C.ClC1=NC=CN=C1Cl.[H-].[Na+] ",
"input": "",
"output": " CC1(C)OCC(COC2=NC=CN=C2Cl)O1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.CCCCCC.CN1CCC2=C(C1)N=CS2.O=C=O.[Li]CCCC Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CN1CCC2=C(C1)N=C(C(=O)[O-])S2.[Li+] ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CCOC(C)=O.COC(=O)CCS(=O)[O-].CS(C)=O.O.O=C(NCC1=CC=C(Br)N=C1)C1=CN=CC2=C1C=NN2C1=CC=C(F)C=C1.[Br-].[Cl-].[Cu]I.[Na+] as the reactants and reagents.",
"input": "",
"output": " COC(=O)CCS(=O)(=O)C1=CC=C(CNC(=O)C2=CN=CC3=C2C=NN3C2=CC=C(F)C=C2)C=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CC(C)(C)OC(=O)N1CCC(C2=NC=NC3=CC(F)=CC=C23)CC1.CC(C)(C)[O-].CS(C)=O.Cl.O.O=C(NC1=CC=C(N2CCCC2)C=C1)OC1=CC=C([N+](=O)[O-])C=C1.OCC1CCOCC1.[K+] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " O=C(NC1=CC=C(N2CCCC2)C=C1)N1CCC(C2=NC=NC3=CC(OCC4CCOCC4)=CC=C23)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC(=O)[O-].CO.Cl.NO.O.O=CC1=CC=C(Cl)C(C(=O)NCC2(O)CCCCCC2)=C1.[Na+] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: O=C(NCC1(O)CCCCCC1)C1=CC(C=NO)=CC=C1Cl .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(=O)O.CC(=O)[O-].COC(=O)C1=C(C)NC(C=O)=C(C(=O)OC)C1C1=CC=CC=C1C#N.Cl.NO.[Na+] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be COC(=O)C1=C(C)NC(C=NO)=C(C(=O)OC)C1C1=CC=CC=C1C#N .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC1=C(Cl)N=NC(NN)=C1C.CN=C=S.ClCCl ",
"input": "",
"output": " CNC(=S)NNC1=NN=C(Cl)C(C)=C1C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CNC1=NS(=O)N=C1OC.CO.NCCCON1C=C(CN2CCCCC2)C=N1 , what product could potentially be produced?",
"input": "",
"output": "The product can be CNC1=NS(=O)N=C1NCCCON1C=C(CN2CCCCC2)C=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CO.COC1(C(F)(F)F)CCC(N)(C(=O)O)CC1.O=S(Cl)Cl , what product could potentially be produced?",
"input": "",
"output": "The product can be COC(=O)C1(N)CCC(OC)(C(F)(F)F)CC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1CCOC1.CCCCN(C)CCC(C)(C)N.O=C(OCC1=CC=CC=C1)ON1C(=O)CCC1=O as the reactants and reagents.",
"input": "",
"output": " CCCCN(C)CCC(C)(C)NC(=O)OCC1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C1CCOC1.COC1=NC(C)=NC(OC)=C1N.O=C([O-])O.S=C(Cl)Cl.[Na+] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " COC1=NC(C)=NC(OC)=C1N=C=S ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC(=O)C1=CC=CC=N1.O=CC1=CC=C(Cl)C=C1 , what product could potentially be produced?",
"input": "",
"output": "The product can be O=C(C=CC1=CC=C(Cl)C=C1)C1=CC=CC=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: COC(=O)[C@@H]1C[C@@H](S(=O)(=O)C2=CC=C(F)C=C2Cl)CN1C1=CC(C)=NN1CCC1=CC=CC=C1.[Li+].[OH-] , what product could potentially be produced?",
"input": "",
"output": "The product can be CC1=NN(CCC2=CC=CC=C2)C(N2C[C@H](S(=O)(=O)C3=CC=C(F)C=C3Cl)C[C@H]2C(=O)O)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC1=CC=C(S(=O)(=O)O)C=C1.CO.COC(C)(C)OC.O.OC[C@H]1C[C@@H](NC2=CC(Cl)=NC=N2)[C@H](O)[C@@H]1O Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CC1(C)O[C@@H]2[C@@H](CO)C[C@@H](NC3=CC(Cl)=NC=N3)[C@@H]2O1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC1=CC=CC=C1.ClC[C@H]1CO1.OC1=NOC(C2=CC=C(Cl)C=C2)=C1 .",
"input": "",
"output": " O=C1C[C@H](C2=CC=C(Cl)C=C2)ON1CC(O)CCl ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " COC1=CC(NC2=NC=C(C(C)NC(=O)C3=CC=CC=C3Br)N=N2)=CC(OC)=C1OC.ClCCCl.O=P(Cl)(Cl)Cl Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " COC1=CC(NC2=NN3C(C4=CC=CC=C4Br)=NC(C)=C3C=N2)=CC(OC)=C1OC ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. C1COCCO1.CC1=CC=CC=C1.CCN(C(C)C)C(C)C.CCN1CC(C)(C)OC2=NC(N3CCOC[C@@H]3C)=NC(C3=CC=C(N)C=C3F)=C2C1=O.CN(C)C=O.NC1=CC=NC=C1.O.O=C(Cl)Cl ",
"input": "",
"output": " CCN1CC(C)(C)OC2=NC(N3CCOC[C@@H]3C)=NC(C3=CC=C(NC(=O)NC4=CC=NC=C4)C=C3F)=C2C1=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1CCOC1.CCOC(=O)C1=CC=C(C2=C(F)C(OC)=CC(OC)=C2F)C2=NC=CN=C12.CO.ClCCl.O=[N+]([O-])C1=NC(CN2CCOCC2)=CN1.[Ni] as the reactants and reagents.",
"input": "",
"output": " COC1=CC(OC)=C(F)C(C2=CC=C(C(=O)NC3=NC(CN4CCOCC4)=CN3)C3=NC=CN=C23)=C1F ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC1=NC(C#CC2=CC=C(Cl)N=C2)=CS1.Cl[Pd](Cl)([PH](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1)[PH](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1.N#CC1=CC=CC=C1B(O)O.O=C([O-])[O-].[K+] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CC1=NC(C#CC2=CC=C(C3=CC=CC=C3C#N)N=C2)=CS1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CS(C)=O.IC1=CC=CC=C1.NC1=CC(O)=CC=C1Cl.O=C(O)C1=CC=CC=N1.O=P([O-])([O-])[O-].[Cu]I.[K+] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: NC1=CC(OC2=CC=CC=C2)=CC=C1Cl .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: COC1=CC=C(CN2C(=O)C3(COC4=CC(F)=C(C#N)C=C43)C3=CC=CC=C32)C=C1.COC1=CC=C(CN2C(=O)C3(COC4=CC(OC)=C(C#N)C=C43)C3=CC=CC=C32)C=C1 .",
"input": "",
"output": " N#CC1=CC2=C(C=C1F)OCC21C(=O)NC2=CC=CC=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CCOC(=O)C(C(=O)OCC)C1=NC(Cl)=CC=C1[N+](=O)[O-].CS(C)=O.Cl.O.[Cl-].[Li+] as the reactants and reagents.",
"input": "",
"output": " CCOC(=O)CC1=NC(Cl)=CC=C1[N+](=O)[O-] ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1COCCO1.CC(C)(C)OC(=O)N1CCN(C(=O)N2CCC(C3=CC=CN=C3)C2)C2=CC=CC=C21.Cl ",
"input": "",
"output": " O=C(N1CCC(C2=CC=CN=C2)C1)N1CCNC2=CC=CC=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CCOC(=O)/C=C/C=C(C1=CC=C(OC)C=C1)C1=CC=C(OC)C=C1.CCOC(=O)C=P(C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1.CO.COC1=CC=C(C(=CC=O)C2=CC=C(OC)C=C2)C=C1.ClC(Cl)(Cl)Cl.[Na+].[OH-] .",
"input": "",
"output": " COC1=CC=C(C(=C/C=C/C(=O)O)C2=CC=C(OC)C=C2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC1=CC(C2=CC=C(Cl)C=C2)=NC(Cl)=N1.IC1=CNC=N1 as the reactants and reagents.",
"input": "",
"output": " CC1=CC(C2=CC=C(Cl)C=C2)=NC(N2C=NC(I)=C2)=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC(=O)O.CC(C)(C)OC(=O)N1CCOC2=CC=C(C3=CN=C(N)C(N)=C3)C=C2C1.CSC(=NC(=O)OCC1=CC=CC=C1)NC(=O)OCC1=CC=CC=C1 ",
"input": "",
"output": " CC(C)(C)OC(=O)N1CCOC2=CC=C(C3=CN=C4N=C(NC(=O)OCC5=CC=CC=C5)NC4=C3)C=C2C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C1=CC=C(OC2=CC=CC=C2)C=C1.CC1=C(C)C(=O)OC1=O.CCCCCC.NC1=NC2=CC=C(OC(F)(F)F)C=C2S1 , what product could potentially be produced?",
"input": "",
"output": "The product can be CC1=C(C)C(=O)N(C2=NC3=CC=C(OC(F)(F)F)C=C3S2)C1=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CN(C)C=O.COC1=CC=CC(F)=C1C#N.[C-]1=CNN=N1.[Na+] ",
"input": "",
"output": " COC1=CC=CC(N2C=NC=N2)=C1C#N ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. NC1=CC=CC(OC2=CC=NC3=C2NC(=O)N3)=C1.O=C(Cl)C1=CC=C(C(F)(F)F)C=C1 ",
"input": "",
"output": " O=C(NC1=CC=CC(OC2=CC=NC3=C2NC(=O)N3)=C1)C1=CC=C(C(F)(F)F)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CO.NC(=O)OCC1C2=C(O)C=C(C=NC3=CC=CC=C3)C=C2N2CC3NC3C1(O)O2.NC(=O)OCC1C2=C(O)C=C(C=O)C=C2N2CC3NC3C1(O)O2.NC1=CC=CC=C1.[Pd] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: NC(=O)OCC1C2=C(O)C=C(CNC3=CC=CC=C3)C=C2N2CC3NC3C1(O)O2 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " ClC(Cl)Cl.ClCCl.NC1=NC=CS1.O=C([O-])[O-].O=CC1=CC=C(C#CC2=CC=CC=N2)O1.[C-]#[N+]C(C)(C)C.[Na+].[O-][Cl+3]([O-])([O-])O Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CC(C)(C)NC1=C(C2=CC=C(C#CC3=CC=CC=N3)O2)N=C2SC=CN12 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C1CCOC1.CC(C)(C)[O-].CCCC1=CC=C(C[P+](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.O.O=CC1CCC(=O)CC1.[Br-].[K+] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CCCC1=CC=C(C=CC2CCC(=O)CC2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C1N2CN3CN1CN(C2)C3.CC(=O)O.Cl.ClCC1=CC=C2OC3=NC=CC=C3CC2=C1.O as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " O=CC1=CC=C2OC3=NC=CC=C3CC2=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC(C)CB(O)O.CC1=CC(C)=CC(C2=CC=C3C(Cl)=CC(Cl)=CC3=N2)=C1.CC1=CC=CC=C1.COC1=CC=CC(OC)=C1C1=CC=CC=C1P(C1CCCCC1)C1CCCCC1.O.O=C(/C=C/C1=CC=CC=C1)/C=C/C1=CC=CC=C1.O=P([O-])([O-])[O-].[K+].[Pd] .",
"input": "",
"output": " CC1=CC(C)=CC(C2=CC=C3C(CC(C)C)=CC(CC(C)C)=CC3=N2)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using Br.COC1=CC=C(N2CC(=O)NC2=O)C=C1OC.COC1=CC=C(NCC(=O)O)C=C1OC.N#C[O-].NCCBr.[K+] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " COC1=CC=C(N2CC(=O)N(CCN)C2=O)C=C1OC ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C=O.CN1C(=O)C[C@H](C2=CC=C(N)C=C2)[C@@H]1[C@H](O)C1=CC=C(C2=CC=CC=C2)S1.CO.C[O-].O.[BH4-].[Na+].[OH-] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CNC1=CC=C([C@H]2CC(=O)N(C)[C@H]2[C@H](O)C2=CC=C(C3=CC=CC=C3)S2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CCN(CC)CC.CN(C)C=O.ClCCl.NCC1CSC1.O.O=C(Cl)C(=O)Cl.O=C(O)C1=CC=C(C2=NOC(C3=CC(Cl)=CC(Cl)=C3)(C(F)(F)F)C2)C=C1 ",
"input": "",
"output": " CC1=CC(C2=NOC(C3=CC(Cl)=CC(Cl)=C3)(C(F)(F)F)C2)=CC=C1C(=O)NCC1CSC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CO.COC(=O)C1(C#N)CC12CCCC2.[BH4-].[H][H].[Na+] as the reactants and reagents.",
"input": "",
"output": " COC(=O)C1(CN)CC12CCCC2 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC1=CC=CC=C1.CC[N+](CC)(CC)CC1=CC=CC=C1.COC1=CC=C(CN2C(=O)C(C)=C(Br)C2=O)C(OC)=C1.Cl[Pd](Cl)([PH](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1)[PH](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1.O.OB(O)C1=CC=C(C(F)(F)F)C=C1.[Cl-].[Cs+].[F-] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " COC1=CC=C(CN2C(=O)C(C)=C(C3=CC=C(C(F)(F)F)C=C3)C2=O)C(OC)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC1=CC=C(S(=O)(=O)Cl)C=C1.CCN(CC)CC.CN(C)C1=CC=NC=C1.ClCCl.NC1=NC(O)=C2CCCCC3=CC=CC=C3C2=N1 .",
"input": "",
"output": " CC1=CC=C(S(=O)(=O)OC2=NC(N)=NC3=C2CCCCC2=CC=CC=C23)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CC#N.CC(C)C(=O)OCCOC(=O)OC1=CC=C(S(C)(=O)=O)C=C1.CCOCC.NCC1(CC(=O)O)CCCCC1.O=C([O-])O.[K+] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CC(C)C(=O)OCCOC(=O)NCC1(CC(=O)O)CCCCC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CO.O.O=C(OCC1=CC=CC=C1)N1CCC2OC2C1.[Cl-].[N-]=[N+]=[N-].[NH4+].[Na+] ",
"input": "",
"output": " [N-]=[N+]=N[C@@H]1CN(C(=O)OCC2=CC=CC=C2)CC[C@H]1O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC1(C)C2=CC=CC(P(C3=CC=CC=C3)C3=CC=CC=C3)=C2OC2=C(P(C3=CC=CC=C3)C3=CC=CC=C3)C=CC=C21.CC[C@@H]1NC(=O)C(F)(F)[C@@H]1O.N#CC1=CC=C(Br)C=C1Cl.O=C(/C=C/C1=CC=CC=C1)/C=C/C1=CC=CC=C1.O=C([O-])[O-].[Cs+].[Pd] .",
"input": "",
"output": " CC[C@H]1[C@@H](O)C(F)(F)C(=O)N1C1=CC=C(C#N)C(Cl)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CC=C(OC2=CC=CC=C2)C=C1.CC(C#N)C1=CC=C(C2CCCCC2)C(F)=C1.CC(C)=O.S Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CC(C#N)C1=CC=C(C2=CC=CC=C2)C(F)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CC=C([PH](C2=CC=CC=C2)(C2=CC=CC=C2)[Pd]([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)[PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.C1COCCO1.O.O=C([O-])[O-].O=C1C(CC2=CC3=CC(Br)=CC=C3S2)CCN1C1CCCCC1.OB(O)C1=CC=NC(F)=C1.[Cl-].[Li+].[Na+] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be O=C1C(CC2=CC3=CC(C4=CC=NC(F)=C4)=CC=C3S2)CCN1C1CCCCC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C1CN2CCN1CC2.CCO.CN(C(=O)OC(C)(C)C)C1CCNC1.ClC1=CC=C2C(Cl)=CC=NC2=C1 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CN(C(=O)OC(C)(C)C)C1CCN(C2=CC=NC3=CC(Cl)=CC=C23)C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC(C)(C)[O-].CN(C)C=O.COC1=CC=C(CCl)C=C1.O=C1NCCC2=NC(Cl)=CC=C12.[K+] as the reactants and reagents.",
"input": "",
"output": " COC1=CC=C(CN2CCC3=NC(Cl)=CC=C3C2=O)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CCCCCC.CCO.COC1=CC=C(/C(=C/[C@H]2CCC(=O)N2)C2=CC=C(C(C)(C)C)C=C2)NC1=O ",
"input": "",
"output": " COC1=CC=C(C(C[C@H]2CCC(=O)N2)C2=CC=C(C(C)(C)C)C=C2)NC1=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC(C)(C)N[C@@H]1CC[C@H](N2CC[C@H](NC(=O)OCC3=CC=CC=C3)C2=O)[C@H](NC(=O)OCC[Si](C)(C)C)C1.CCN(CC)CC.CS(=O)(=O)Cl.ClCCl.O=C(O)C(F)(F)F as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CC(C)(C)N[C@@H]1CC[C@H](N2CC[C@H](NC(=O)OCC3=CC=CC=C3)C2=O)[C@H](NS(C)(=O)=O)C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. BrC1=CC=NC=C1.C1=CC=C([PH](C2=CC=CC=C2)(C2=CC=CC=C2)[Pd]([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)[PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.CC1(C)C2=CC=CC(P(C3=CC=CC=C3)C3=CC=CC=C3)=C2OC2=C(P(C3=CC=CC=C3)C3=CC=CC=C3)C=CC=C21.Cl.O=C([O-])[O-].O=C1NC2CCC1CC2.[Cs+] ",
"input": "",
"output": " O=C1C2CCC(CC2)N1C1=CC=NC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC1=CC(O)=NC(S)=N1.FC1=CC=CC(F)=C1CBr Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CC1=CC(O)=NC(SCC2=C(F)C=CC=C2F)=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC#N.CC1=CN=C(NC(=O)C2=CC(O)=CC(O[C@@H](C)CO[Si](C)(C)C(C)(C)C)=C2)C=N1.CCOC(C)=O.O=C(C1=CN=C(Cl)C=N1)N1CCC1.O=C([O-])[O-].[K+] .",
"input": "",
"output": " CC1=CN=C(NC(=O)C2=CC(OC3=CN=C(C(=O)N4CCC4)C=N3)=CC(O[C@@H](C)CO[Si](C)(C)C(C)(C)C)=C2)C=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C1CCNCC1.CN(C)C=O.C[C@H](NC(=O)OCC1C2=CC=CC=C2C2=CC=CC=C21)C(=O)N[C@@H](CC1=CC=C(O)C=C1)C(=O)NCC(=O)OC(C)(C)C , what product could potentially be produced?",
"input": "",
"output": "The product can be C[C@H](N)C(=O)N[C@@H](CC1=CC=C(O)C=C1)C(=O)NCC(=O)OC(C)(C)C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)O)C1.CCN=C=NCCCN(C)C.CN(C)C=O.CN1CCOCC1.Cl.NC1=CC=CC=C1N.O.ON1N=NC2=CC=CC=C21 Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NC2=CC=CC=C2N)C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC#N.IC1=CN(C(C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=N1.N#CC1=CC=C(CBr)C(F)=C1 Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be N#CC1=CC=C(CN2C=NC=C2I)C(F)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) BrC1=CC=CC2=C1C=NN2.C1=CC=C([PH](C2=CC=CC=C2)(C2=CC=CC=C2)[Pd]([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)[PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.CN1CCCC1=O.[C-]#N.[Zn+2] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: N#CC1=CC=CC2=C1C=NN2 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using BrC1=CC=C(C2=CC=CC=C2)C=C1.BrCCBr.C1CCOC1.O=C(C1=CC=CC=C1)C1=CC=NC=C1.[Cl-].[MgH2].[NH4+] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " OC(C1=CC=CC=C1)(C1=CC=NC=C1)C1=CC=CC=C1C1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1=CNC=N1.CC(C)(C)[Si](Cl)(C1=CC=CC=C1)C1=CC=CC=C1.CN(C)C=O.O=CCO as the reactants and reagents.",
"input": "",
"output": " CC(C)(C)[Si](OCC=O)(C1=CC=CC=C1)C1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CCOCC.Cl.NC1=CC=C(Br)C=C1C(=O)O.O=C(O)CCl.O=C([O-])[O-].[Na+] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: O=C(O)CNC1=CC=C(Br)C=C1C(=O)O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC(=O)N(C)C.CC(C)CN1N=CC2=CC(OC3=CC=C(F)C=C3F)=C(Br)C=C21 .",
"input": "",
"output": " CC(C)CN1N=CC2=CC(OC3=CC=C(F)C=C3F)=C(C#N)C=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CC=C(P(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.CC1(C)OCC(CO)CO1.CC1=CC=CC=C1.CCN=C=NN=NN=C=NCC.COC1=CC2=C(OC3=CC=C(C)N=C3C3=NC=CS3)C=CN=C2C=C1O.O.O=S(=O)(O)O Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be COC1=CC2=C(OC3=CC=C(C)N=C3C3=NC=CS3)C=CN=C2C=C1OCC(CO)CO .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CO.COC(=O)COC1=CC=C(CC(C)NCC(O)C2=CSC(C)=N2)C=C1.N.O as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CC1=NC(C(O)CNC(C)CC2=CC=C(OCC(N)=O)C=C2)=CS1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C1=CC=C2SC=CC2=C1.C1CCOC1.COC1=CC(C=O)=CC(OC)=C1OC.[Li]C(C)(C)C , what product could potentially be produced?",
"input": "",
"output": "The product can be COC1=CC(C(O)C2=CC3=CC=CC=C3S2)=CC(OC)=C1OC .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)(C)O.CN(C)C1=CC=CC=C1.Cl.ClCCl.O=C(Cl)CC1CCCCC1 Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CC(C)(C)OC(=O)CC1CCCCC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CS(=O)(=O)NN1C(=O)NC2=CC([N+](=O)[O-])=C(F)C=C2C1=O.NC(CO)CO is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CS(=O)(=O)NN1C(=O)NC2=CC([N+](=O)[O-])=C(NC(CO)CO)C=C2C1=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CC=C(P(C2=CC=CC=C2)[C-]2C=CC=C2)C=C1.CC1(C)O/C(=C2/C(=O)NC3=CC(I)=CC=C23)C=C1N1CCOCC1.CN(C)C=O.COC(=O)C1=CC=CC=C1S.ClCCl.Cl[Pd]Cl.O=C([O-])[O-].[Cs+].[Fe+2] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be COC(=O)C1=CC=CC=C1SC1=CC=C2/C(=C3/C=C(N4CCOCC4)C(C)(C)O3)C(=O)NC2=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CI.CN(C)C=O.O=C1NC(=O)C2(CCCCC2)N1.[H-].[Na+] ",
"input": "",
"output": " CN1C(=O)NC2(CCCCC2)C1=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CN(C)CCCN.COC(=O)CN1N=C(C2=CC=C(NS(=O)(=O)C3=CC=CC(Cl)=C3Cl)C(F)=C2)C2=C(N)N=CN=C21 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CN(C)CCCNC(=O)CN1N=C(C2=CC=C(NS(=O)(=O)C3=CC=CC(Cl)=C3Cl)C(F)=C2)C2=C(N)N=CN=C21 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC(C)(C)OC(=O)N1CCCC[C@H]1C(=O)NC1=CC=C2NC(C(=O)NCC3=CC=C(Cl)C(OC4=CC(Cl)=CC(C#N)=C4)=C3F)=CC2=C1.ClCCl.O=C(O)C(F)(F)F ",
"input": "",
"output": " N#CC1=CC(Cl)=CC(OC2=C(Cl)C=CC(CNC(=O)C3=CC4=CC(NC(=O)[C@@H]5CCCCN5)=CC=C4N3)=C2F)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.C=CCOCCCCCOC1=C(Cl)C=C(OCC=C(Cl)Cl)C=C1Cl.O=S(=O)(O)O.O=S(=O)([O-])[O-].[Hg+2] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CC(=O)COCCCCCOC1=C(Cl)C=C(OCC=C(Cl)Cl)C=C1Cl .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)(C)OC(=O)[C@H](CC1=CC=C(O)C=C1)NC(=O)OCC1=CC=CC=C1.COCCOCCBr Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " COCCOCCOC1=CC=C(C[C@H](NC(=O)OCC2=CC=CC=C2)C(=O)OC(C)(C)C)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C#CCC(C(=O)O)N1C=C(OC)C(C2=CC(Cl)=CC=C2C#N)=CC1=O.CC(C)(C)OC(=O)C1=CC=C(N)C=C1 .",
"input": "",
"output": " C#CCC(C(=O)NC1=CC=C(C(=O)OC(C)(C)C)C=C1)N1C=C(OC)C(C2=CC(Cl)=CC=C2C#N)=CC1=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) N#CC(C#N)=CC1=CC=C(Cl)C=C1Cl.N=C(N)C1=CC=CC2=CC=CC=C12 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: NCC1=C(N)N=C(C2=CC=CC3=CC=CC=C23)N=C1C1=CC=C(Cl)C=C1Cl .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.CCOC(=O)C(F)(F)F.Cl.N=C(N)C1=CC=CC(I)=C1.NN.[Na+].[OH-] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " FC(F)(F)C1=NN=C(C2=CC=CC(I)=C2)N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CC(C)N1CCC(OC2=CC=C3C(=C2)C=C(C(=O)N2CCNCC2)N3CC(F)F)CC1.Cl.O=S(=O)(Cl)CC(F)(F)F as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CC(C)N1CCC(OC2=CC=C3C(=C2)C=C(C(=O)N2CCN(S(=O)(=O)CC(F)(F)F)CC2)N3CC(F)F)CC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C#CC1=CC=CS1.CS(C)=O.ClC1=CC=C(I)C=C1.O.O=C(O)[C@@H]1CCCN1.O=C([O-])[O-].O=C1O[C@H]([C@@H](O)CO)C([O-])=C1O.[N-]=[N+]=[N-].[Na+] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be ClC1=CC=C(N2C=C(C3=CC=CS3)N=N2)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1=CC=NC=C1.CC1(C)CC(C2=CC=CC=C2N)NC2=CC=C(Cl)C=C21.ClCCl.O=S(=O)(Cl)C1=CC=CC(F)=C1 ",
"input": "",
"output": " CC1(C)CC(C2=CC=CC=C2NS(=O)(=O)C2=CC=CC(F)=C2)NC2=CC=C(Cl)C=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.CC(C)[Si](C(C)C)(C(C)C)N1CC(C)(C)C2=CC(F)=C(Br)C=C21.O=S(=O)(F)C1=CC=CC=C1.[Li]CCCC Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CC(C)[Si](C(C)C)(C(C)C)N1CC(C)(C)C2=CC(F)=C(S(=O)(=O)C3=CC=CC=C3)C=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCCCCCCCCCCCCCCCCCOC1=CC(OCC2=CC=CC=C2)=CC(C(=O)O)=C1.COC(=O)CNCC(=O)OC.O=S(Cl)Cl Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CCCCCCCCCCCCCCCCCCOC1=CC(OCC2=CC=CC=C2)=CC(C(=O)N(CC(=O)OC)CC(=O)OC)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.CC1(C2=CC=C3C=C(Br)C=CC3=C2)OCCO1.O=CC1=CC=CN=C1.[Li]C(C)(C)C Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CC1(C2=CC=C3C=C(C(O)C4=CC=CN=C4)C=CC3=C2)OCCO1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C.CCOC(=O)CNC1=NC=CC=C1NC(=O)C1=CC=C(Cl)C=C1.ClCCl .",
"input": "",
"output": " CCOC(=O)CN1C(C2=CC=C(Cl)C=C2)=NC2=CC=CN=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC1=CN(CCCN)C=N1.COC(=O)C1=C(N=C=S)SC(C2=CC=CC=C2)=C1 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC1=CN(CCCN2C(=S)NC3=C(C=C(C4=CC=CC=C4)S3)C2=O)C=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC#N.CS(=O)(=O)C1CC2=CC(Cl)=CC=C2C1=O.F[B-](F)(F)F.F[N+]12CC[N+](CCl)(CC1)CC2.O ",
"input": "",
"output": " CS(=O)(=O)C1(F)CC2=CC(Cl)=CC=C2C1=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " COC1=CC(C)=C(Br)C(C)=N1.ClC(Cl)(Cl)Cl.O=C(OOC(=O)C1=CC=CC=C1)C1=CC=CC=C1.O=C1CCC(=O)N1Br Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be COC1=CC(C)=C(Br)C(CBr)=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC(=O)C1=CC2=C(OCC(=O)N2)C(C(C)(C)C)=C1.CCCC[N+](CCCC)(CCCC)CCCC.CO.ClC(Cl)Cl.ClCCl.[Br-] as the reactants and reagents.",
"input": "",
"output": " CC(C)(C)C1=CC(C(=O)CBr)=CC2=C1OCC(=O)N2 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CCO.CCOC(=O)C1=CC=C2SC(COC)=NC2=C1.[Na+].[OH-] as the reactants and reagents.",
"input": "",
"output": " COCC1=NC2=CC(C(=O)O)=CC=C2S1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCCOC1=NC(C(=O)N[C@H](CO)CC(C)C)=CN=C1N1CCCC1.COC(=O)[C@@H](N)CC(C)C.COCCOC1=NC(C(=O)O)=CN=C1N1CCCCC1 Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " COCCOC1=NC(C(=O)N[C@@H](CC(C)C)C(=O)OC)=CN=C1N1CCCCC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CCOC(C)=O.CI.CN(C)C=O.COC1=CC=C(CN(C2=NC=NS2)S(=O)(=O)C2=CC(F)=C(OC3=CC=C(Cl)C=C3C3=CC=C4ON=C(NC(=O)OC(C)(C)C)C4=C3)C=C2F)C(OC)=C1.[Cl-].[H-].[NH4+].[Na+] .",
"input": "",
"output": " COC1=CC=C(CN(C2=NC=NS2)S(=O)(=O)C2=CC(F)=C(OC3=CC=C(Cl)C=C3C3=CC=C4ON=C(N(C)C(=O)OC(C)(C)C)C4=C3)C=C2F)C(OC)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C1CCOC1.CCO.CCOC(=O)C1=C(C)ON=C1C1=NC=CC=C1F.Cl.O.[Na+].[OH-] , what product could potentially be produced?",
"input": "",
"output": "The product can be CC1=C(C(=O)O)C(C2=NC=CC=C2F)=NO1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C#CC(C)(O)C1=NC=CS1.C1=CC=C([PH](C2=CC=CC=C2)(C2=CC=CC=C2)[Pd]([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)[PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.C1CCNCC1.NC1=CC=NC(N2C=NC3=CC=C(Br)C=C32)=N1.[Cu]I is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC(O)(C#CC1=CC=C2N=CN(C3=NC=CC(N)=N3)C2=C1)C1=NC=CS1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CCOC(C)=O.CO.COC1=CC=C(N2N=C(C#N)C=C2C(=O)C(C(=O)[O-])C2=CC=C(N3C=CC=CC3=O)C=C2F)C=C1.O=C([O-])O.O=S(=O)(O)O ",
"input": "",
"output": " COC1=CC=C(N2N=C(C#N)C=C2C(=O)CC2=CC=C(N3C=CC=CC3=O)C=C2F)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1COCCN1.COC1(C2=CC=C(SC)C=C2)OC1(C)C Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CSC1=CC=C(C(=O)C(C)(C)N2CCOCC2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC(=O)O[C@@H](C)C(=O)Cl.CC1=C(C(=O)NC2CCNCC2)C2=NC=CC(C3=C4OCOC4=CC=C3OCC3CC3)=C2N1.Cl ",
"input": "",
"output": " CC1=C(C(=O)NC2CCN(C(=O)[C@H](C)O)CC2)C2=NC=CC(C3=C4OCOC4=CC=C3OCC3CC3)=C2N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C1COCCO1.CC(=O)C1=CC=C(Cl)N=C1.CC(=O)O.CC(C)O.ClC(Cl)Cl.NO.O .",
"input": "",
"output": " CC(=NO)C1=CC=C(Cl)N=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC(C)(C)CC(C)(C)N.CN1CCCC1=O.COC(=O)C1=CC(F)=C(NC(C)(C)C)N=C1F.ClC(Cl)Cl as the reactants and reagents.",
"input": "",
"output": " COC(=O)C1=CC(F)=C(NC(C)(C)C)N=C1NC(C)(C)CC(C)(C)C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CCOC(C)=O.CI.CN(C)C=O.COC1=CC=C(N(C(=O)CN2C(=O)C(CC3=NN(CC4=CC=CC=C4)C4=CC=CC=C34)C(=O)N(C3=CC=CC=C3)C3=CC=CC=C32)C(C)C)C=C1.C[Si](C)(C)[N-][Si](C)(C)C.[Na+] ",
"input": "",
"output": " COC1=CC=C(N(C(=O)CN2C(=O)C(C)(CC3=NN(CC4=CC=CC=C4)C4=CC=CC=C34)C(=O)N(C3=CC=CC=C3)C3=CC=CC=C32)C(C)C)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using ClCl.FC(F)(Cl)C(F)(Cl)Cl.FC1(F)OC(Cl)=C(Cl)OC1(F)F as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " FC1(F)OC(Cl)(Cl)C(Cl)(Cl)OC1(F)F ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)=O.Cl.NS(=O)(=O)C1=CSC=C1.O=C=NC1=CC=C(Cl)C=C1.[Na+].[OH-] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be O=C(NC1=CC=C(Cl)C=C1)NS(=O)(=O)C1=CSC=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: COC(=O)C1=C(C2=CC=C(Br)C(C)=C2)ON=C1C.[Li+].[OH-] .",
"input": "",
"output": " CC1=CC(C2=C(C(=O)O)C(C)=NO2)=CC=C1Br ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.CO.COC(=O)C1=CC2=C(C=C1OC(C)=O)CC[C@@H]1[C@@H]2CC[C@]2(C)C(=O)CC[C@@H]12.[H-].[Na+] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be COC(=O)C1=CC2=C(C=C1O)CC[C@@H]1[C@@H]2CC[C@]2(C)C(=O)CC[C@@H]12 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: ClC1=CC=C(Cl)N=N1.N.O.O=C(O)C12CCC(CC1)C2.O=S(=O)(O)O.O=S(=O)([O-])OOS(=O)(=O)[O-].O=[N+]([O-])[O-].[Ag+].[NH4+] .",
"input": "",
"output": " ClC1=CC(C23CCC(CC2)C3)=C(Cl)N=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC1=NC2=C(C=CC3=CC=CC=C32)S1.ClC(Cl)(Cl)Cl.O=C(OOC(=O)C1=CC=CC=C1)C1=CC=CC=C1.O=C1CCC(=O)N1Br as the reactants and reagents.",
"input": "",
"output": " BrCC1=NC2=C(C=CC3=CC=CC=C32)S1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CC1=C(CCl)N=C(C2=CC=CC=C2)O1.COC(=O)C1=CC2=CC(O)=CC=C2O1 as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " COC(=O)C1=CC2=CC(OCC3=C(C)OC(C4=CC=CC=C4)=N3)=CC=C2O1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C1=CNC=N1.CN1CCCC1=O.O.O=C(NC1=NC(C2=CC=CO2)=C(C2=CC=NC=C2)S1)C1=CC=C(CBr)C=C1 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: O=C(NC1=NC(C2=CC=CO2)=C(C2=CC=NC=C2)S1)C1=CC=C(CN2C=CN=C2)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with COC1=CC=C2C(=O)NC=C(N3CCN(C)CC3)C2=C1.O=P(Cl)(Cl)Cl as the reactants and reagents.",
"input": "",
"output": " COC1=CC=C2C(Cl)=NC=C(N3CCN(C)CC3)C2=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCCC1=C(OCC2=CC=C(N)C=C2)C=CC(C(C)=O)=C1O.CCOC(=O)C1=CC=CC(N=C=O)=C1.ClCCl Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CCCC1=C(OCC2=CC=C(NC(=O)NC3=CC=CC(C(=O)OCC)=C3)C=C2)C=CC(C(C)=O)=C1O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CC(C)(C/C=C/C(=O)O)NC(=O)OC(C)(C)C.CCN(C(C)C)C(C)C.CCN=C=NCCCN(C)C.CN[C@H](CC1=CC=C2C=CC=CC2=C1)C(=O)N(C)[C@H](CC1=CC=CC=C1)C(=O)N(C)NC(C)=O.Cl.ClCCl.ON1N=NC2=CC=CN=C21 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CC(=O)NN(C)C(=O)[C@@H](CC1=CC=CC=C1)N(C)C(=O)[C@@H](CC1=CC=C2C=CC=CC2=C1)N(C)C(=O)/C=C/CC(C)(C)NC(=O)OC(C)(C)C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC#N.CCCCOC(=O)[C@H]1[C@@H](N2C(=O)C3=CC=CC=C3C2=O)C(=O)N1C(C1=CC=CC=C1)C1=CC=CC=C1.O.O=P([O-])([O-])O.O=S(=O)([O-])OOS(=O)(=O)[O-].[K+].[Na+] ",
"input": "",
"output": " CCCCOC(=O)[C@@H]1NC(=O)[C@@H]1N1C(=O)C2=CC=CC=C2C1=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " COCOC1=CC(C(F)(F)F)=CC=C1C1=CC(OC2=CC=CC3=C2N=C(NC(C)=O)S3)=NC=N1.ClCCl.O=C(O)C(F)(F)F Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CC(=O)NC1=NC2=C(OC3=CC(C4=CC=C(C(F)(F)F)C=C4O)=NC=N3)C=CC=C2S1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)(C)C(=O)C1=CNC2=NC=C(C3=CC=C4C=CNC4=C3)N=C12.CC(C)(C)C(=O)C1=CNC2=NC=C(C3=CC=C4NC=CC4=C3)N=C12 Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CC(C)(C)C(=O)C1=CNC2=NC=C(C3=CC=CC4=C3C=CN4)N=C12 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CCN(CC)CC.CCOC(=O)CC(=O)C1=CC=CO1.CI.CN(C)C=O.CS(C)=O.N=C(N)N.O=[N+]([O-])O.S=C=S.[H-].[Na+] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CCOC(=O)C1=C(SC)N=C(N)N=C1C1=CC=CO1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1CCCCC1.CCCCCC.CCOCC.CN(C)CCN(C)C.COC1=CC=CC2=CC=CC=C12.Cl.O=C=O.[Li]CCCC ",
"input": "",
"output": " COC1=C(C(=O)O)C=CC2=CC=CC=C12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC1=CC=CC=C1.C[O-].Cl.NNC1=CC=C(Br)C=C1.O.O=C(C1=CC=CC=C1)C(C(=O)C1=CC=CC=C1)C1=CC=CC=C1.[Na+] as the reactants and reagents.",
"input": "",
"output": " BrC1=CC=C(N2N=C(C3=CC=CC=C3)C(C3=CC=CC=C3)=C2C2=CC=CC=C2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. COC(=O)C1=CC(S(C)(=O)=O)=CC=C1OC.[K+].[OH-] ",
"input": "",
"output": " COC1=CC=C(S(C)(=O)=O)C=C1C(=O)O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CN(C)C=O.ClCCCl.O=C([O-])O.O=C=NC1=CC=CC=C1OC1=CC=CC=C1.OC1=CC=CC=C1C1CC(C2=CC=CN=C2)=NN1.[Na+] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: O=C(NC1=CC=CC=C1OC1=CC=CC=C1)N1N=C(C2=CC=CN=C2)CC1C1=CC=CC=C1O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CCCCC1=NC2=CC=C(N(C(=O)OCC)C3CCCCC3)C=C2N1CC1=CC=C(C2=CC=CC=C2C(=O)OC(C)(C)C)C=C1.O=C(O)C(F)(F)F ",
"input": "",
"output": " CCCCC1=NC2=CC=C(N(C(=O)OCC)C3CCCCC3)C=C2N1CC1=CC=C(C2=CC=CC=C2C(=O)O)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CCOC(=O)C(CC1=CC=C(C(=O)OC)C=C1OC)C(C)=O.CO.N=C(N)N.O=C(O)O ",
"input": "",
"output": " COC(=O)C1=CC=C(CC2=C(C)N=C(N)N=C2O)C(OC)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C1=CC=CC=C1.CC(=O)O.CCCCCCC1=CC=C(O)C=C1.O.O=[N+]([O-])O .",
"input": "",
"output": " CCCCCCC1=CC=C(O)C([N+](=O)[O-])=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with BrCC1=CC=CC=C1.CC(=O)N(C)C.CS(=O)(=O)C1=CC=CC(C2=CC=C(CNS(=O)(=O)C3=CC=CC=C3Cl)S2)=C1.[H-].[Na+] as the reactants and reagents.",
"input": "",
"output": " CS(=O)(=O)C1=CC=CC(C2=CC=C(CN(CC3=CC=CC=C3)S(=O)(=O)C3=CC=CC=C3Cl)S2)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CC=C2C3=C(CC2=C1)CC(N1CCCC1)CC3.C1CCOC1.CCO.CCOCC.N.[LiH] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " C1=CCC2=C(C1)CC1CC(N3CCCC3)CCC21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CCC1=CC=C(C)C(NC(=O)C(C)(C)C)=N1.CCOCC.CN(C)C=O.Cl.[Li]C(C)(C)C ",
"input": "",
"output": " CCC1=CC=C2C=CNC2=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C/C(=N\\[Si](C)(C)C)O[Si](C)(C)C.CC(=O)O[C@@H]1OC[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O.CO.C[Si](C)(C)OS(=O)(=O)C(F)(F)F.ClCCCl.FC1=CC2=C(C=C1F)NC=N2.O=C([O-])O.[Na+] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CC(=O)O[C@@H]1[C@H](OC(C)=O)[C@H](OC(C)=O)CO[C@H]1N1C=NC2=CC(F)=C(F)C=C21 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) Br.C1CCOC1.CCO.O=C(CBr)C1=CC=C(Cl)C=C1.O=C1CCN(CC2=CC=CC=C2)CC1.[Ce+3].[Cl-].[I-].[Na+] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: O=C(CC1(O)CCN(CC2=CC=CC=C2)CC1)C1=CC=C(Cl)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C=CCN.CC1=CSC2=C(NCC(C)(C)C)N=C(Cl)N=C12.O as the reactants and reagents.",
"input": "",
"output": " C=CCNC1=NC(NCC(C)(C)C)=C2SC=C(C)C2=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.CC1(C)OC(C2=CC=C(N(S(C)(=O)=O)S(C)(=O)=O)C=C2)=C(C2=CC=C(OCC3=CC=C4C=CC=CC4=N3)C=C2)C1=O.O.[Na+].[OH-] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CC1(C)OC(C2=CC=C(NS(C)(=O)=O)C=C2)=C(C2=CC=C(OCC3=CC=C4C=CC=CC4=N3)C=C2)C1=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CC=C(P(C2=CC=CC=C2)[C-]2C=CC=C2)C=C1.CC#N.CC(=O)[O-].C[C@@H]1CN(C2=CC=C(NC3=CC(B4OC(C)(C)C(C)(C)O4)=CN(C)C3=O)N=C2)[C@@H](C)CN1C1COC1.Cl[Pd]Cl.O.O=CC1=C(Cl)C=CN=C1N1N=CC2=C(SC3=C2CCCC3)C1=O.O=P([O-])([O-])[O-].[Fe+2].[K+].[Na+] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CC1CN(C2COC2)C(C)CN1C1=CC=C(NC2=CC(C3=CC=NC(N4N=CC5=C(SC6=C5CCCC6)C4=O)=C3C=O)=CN(C)C2=O)N=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.CC(=O)O.CC(=O)O[BH-](OC(C)=O)OC(C)=O.CC1=CC=C(NC2CCNCC2)N=C1.COC(=O)C1(CC=O)CCCCC1.O=C([O-])O.[Na+] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be COC(=O)C1(CCN2CCC(NC3=CC=C(C)C=N3)CC2)CCCCC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CO.COC(=O)CN=[N+]=[N-].C[O-].O=CC1=CC=CC=C1Br.[Na+] ",
"input": "",
"output": " COC(=O)C(=CC1=CC=CC=C1Br)N=[N+]=[N-] ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCOCC.CN(C)C1=CC=C2N=CNC(=O)C2=C1.O=P(Cl)(Cl)Cl Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CN(C)C1=CC=C2N=CN=C(Cl)C2=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CC(C)OC1=CC=C(C(=N)NO)C=C1I.CC1=CC2=CC(C(=N)NO)=CC=C2O1.CCCOC1=CC=C(C(=O)O)C=C1Cl.CCOC1=CC=C(C(=O)O)C=C1OCC as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CCOC1=CC=C(C2=NC(C3=CC=C4OC(C)=CC4=C3)=NO2)C=C1OCC ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C1CCOC1.CC(=O)C1=C2SC=CN2C(C)=N1.CCCCCC.CCCC[Sn](Cl)(CCCC)CCCC.C[Si](C)(C)[N-][Si](C)(C)C.[Cl-].[Li+].[Li]CCCC.[NH4+] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CCCC[Sn](CCCC)(CCCC)C1=CN2C(C)=NC(C(C)=O)=C2S1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " COCN1C2=CC(C(=O)CC(C)=O)=CC=C2SC2=NC=CN=C21.COCN1C2=CC(C3=CON=C3C)=CC=C2SC2=NC=CN=C21.NO Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CC1=NOC=C1C1=CC=C2SC3=NC=CN=C3NC2=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC[SiH](CC)CC.CN1C=NC(C=O)=C1S(=O)(=O)C1=CC=CC=C1.COC(=O)CN1C(C)=CC2=CC(F)=CC=C21.ClCCCl.ClCCl.O=C(O)C(F)(F)F .",
"input": "",
"output": " COC(=O)CN1C(C)=C(CC2=C(S(=O)(=O)C3=CC=CC=C3)N(C)C=N2)C2=CC(F)=CC=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1CCOC1.CCOC(C)=O.CN(C)C=O.COC1=CC=CC2=C1NC(=O)[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]21.O.O=C1CCC(=O)N1Br ",
"input": "",
"output": " COC1=CC(Br)=CC2=C1NC[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC(C)CN(C)C1=CC(NC(=O)OC(C)(C)C)=C(NC(=O)CC(=O)C2=CC=CC(N3N=NC=C3COC3CCCCO3)=C2)C=C1Cl.ClCCl.O=C(O)C(F)(F)F , what product could potentially be produced?",
"input": "",
"output": "The product can be CC(C)CN(C)C1=CC2=C(C=C1Cl)NC(=O)CC(C1=CC=CC(N3N=NC=C3CO)=C1)=N2 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC(=O)Cl.Cl.O=C(NC1CCNCC1)C1=CNC2=C(C3=CC(F)=CC=C3OCC3CC3)N=CN=C12 as the reactants and reagents.",
"input": "",
"output": " CC(=O)N1CCC(NC(=O)C2=CNC3=C(C4=CC(F)=CC=C4OCC4CC4)N=CN=C23)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CCN.O=C=NCCCl.O=C[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CCN(C(=O)NCCCl)C1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C1CCOC1.C[Mg]Cl.O.O=C1CCCOC2=CC=CC=C12.[Cl-].[NH4+] , what product could potentially be produced?",
"input": "",
"output": "The product can be CC1(O)CCCOC2=CC=CC=C21 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CCN(CC)CC.CS(=O)(=O)Cl.ClCCl.N#CC1=CC=C(OC2=CC=C(CO)C=C2)C=C1C#N , what product could potentially be produced?",
"input": "",
"output": "The product can be CS(=O)(=O)CC1=CC=C(OC2=CC=C(C#N)C(C#N)=C2)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C=O.CC(=O)O[BH-](OC(C)=O)OC(C)=O.COC(=O)[C@]1(COCC2=CC=CC=C2)CCCN1.ClCCl.[Na+] ",
"input": "",
"output": " COC(=O)[C@]1(COCC2=CC=CC=C2)CCCN1C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C#C[Si](C)(C)C.C1CCOC1.COC(=O)C1=CC=C(O)C(I)=C1.ClC(Cl)Cl.Cl[Pd](Cl)([PH](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1)[PH](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1 ",
"input": "",
"output": " COC(=O)C1=CC=C(O)C(C#C[Si](C)(C)C)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C1COCCO1.CCCCNC1=NC(N)=C2N=C(OC)N(CCCC3CCOC(C)(C)C3)C2=N1.CO.Cl.ClCCl .",
"input": "",
"output": " CCCCNC1=NC(N)=C2NC(=O)N(CCCC3CCOC(C)(C)C3)C2=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C1CCOC1.CC1=NOC(C)=C1C1=C(/C(N)=N/O)C2=CC=CC=C2N1C1=CC=C(O)C=C1.CCOC=O.[H-].[Na+] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC1=NOC(C)=C1C1=C(C2=NOC=N2)C2=CC=CC=C2N1C1=CC=C(O)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CNC=N1.CN(C)C=O.COC1=CC=C2C=C(Br)C=CC2=N1.O=C(O)CN(CCN(CC(=O)O)CC(=O)O)CC(=O)O.O=C([O-])[O-].[Cu]I.[K+] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be COC1=CC=C2C=C(N3C=CN=C3)C=CC2=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if BrCCC=C(C1=CC=CC=C1)C1=CC=CC=C1.CN(C)P(=O)(N(C)C)N(C)C.O.[C-]#N.[Na+] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " N#CCCC=C(C1=CC=CC=C1)C1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CO.COC(=O)CCSC(C1=CC=CC=C1)C1(OC)CCOCC1.O Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be COC1(C(SCCC(=O)O)C2=CC=CC=C2)CCOCC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with NCC1CN(CC2=CC=C(Cl)C(Cl)=C2)CCO1.O=C=NC1CCCCC1 as the reactants and reagents.",
"input": "",
"output": " O=C(NCC1CN(CC2=CC=C(Cl)C(Cl)=C2)CCO1)NC1CCCCC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C1=CC=C(P(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.CC(=O)[O-].CCCC1=NC2=CN=C3C=C(Br)C=CC3=C2N1CCCC(C)=O.CCCO.O=C([O-])[O-].OB(O)C1=CC=CC=C1.[Na+].[Pd+2] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CCCC1=NC2=CN=C3C=C(C4=CC=CC=C4)C=CC3=C2N1CCCC(C)=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses COC1=CC=CC(F)=C1C1=CC=CC(N2C=NC(C(=O)N(C)OC)=C2)=C1.FC1=CC=CC(Br)=C1 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: COC1=CC=CC(F)=C1C1=CC=CC(N2C=NC(C(=O)C3=CC=CC(F)=C3)=C2)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC1=NOC([C@H](N)CC2=CC=C(C3=CC=C(F)C(Cl)=C3)C=C2)=N1.COC1=CC=C(C2=CC=C(C(F)(F)F)C=C2)C=C1C(=O)Cl ",
"input": "",
"output": " COC1=CC=C(C2=CC=C(C(F)(F)F)C=C2)C=C1C(=O)N[C@H](CC1=CC=C(C2=CC=C(F)C(Cl)=C2)C=C1)C1=NC(C)=NO1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC(C)(C)C(=O)NCC1=CC=C(Cl)C(C(=O)O)=C1.CCN(C(C)C)C(C)C.CN(C)C=O.ClCCl.NC1=CC=CC2=C(OC3=CC=CC(C(F)(F)F)=C3)C=CN=C12.O=C(Cl)C(=O)Cl as the reactants and reagents.",
"input": "",
"output": " CC(C)(C)C(=O)NCC1=CC=C(Cl)C(C(=O)NC2=CC=CC3=C(OC4=CC=CC(C(F)(F)F)=C4)C=CN=C23)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1CCOC1.CC=O.CCOC(C)OCC.CCOCC.FB(F)F.O=C([O-])O.O=C([O-])[O-].OC1CCNC2=CC=C(F)C=C2C1O.[K+].[Na+] ",
"input": "",
"output": " CC1OC2C3=CC(F)=CC=C3N3CCC2(CC3)O1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) COC1=CC=C(C2=CC(Cl)=NN=C2C2=CC=C(OC)C=C2)C=C1.OC1=C(F)C=CC=C1F as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: COC1=CC=C(C2=CC(OC3=C(F)C=CC=C3F)=NN=C2C2=CC=C(OC)C=C2)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CC(C)(C)[Si](C)(C)Cl.CC1=CC=CC=C1.CCN(CC)CC.O=C1C=CNN2C=CC=C12 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CC(C)(C)[Si](C)(C)OC1=CC=NN2C=CC=C12 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1CCOC1.CC(C)C[Mg]Cl.CON(C)C(=O)C1=CC=C(O)N=C1 ",
"input": "",
"output": " CC(C)CC(=O)C1=CC=C(O)N=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCN(CC)CC.CCN=C=NCCCN(C)C.CN(C)CC(=O)O.CN1CCCC1=O.Cl.O=[N+]([O-])C1=CC=C(N2CCNCC2)C=C1.ON1N=NC2=CC=CC=C21 Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CN(C)CC(=O)N1CCN(C2=CC=C(N)C=C2)CC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CCOC(=O)C(C(=O)OCC)C1C=CCCC1.CO.O.[K+].[OH-] .",
"input": "",
"output": " O=C(O)CC1C=CCCC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CCC(C)N.CCOCC.S=P(Cl)(Cl)Cl as the reactants and reagents.",
"input": "",
"output": " CCC(C)NP(=S)(Cl)Cl ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC1=CC(C(=O)/C=C(\\C2=CC(Cl)=CC(Cl)=C2)C(F)(F)F)=CC=C1C(=O)OC(C)(C)C.CC1=CC=CC=C1.CN(C)[C@@H]1CCCC[C@H]1NC(=S)NC1=CC(C(F)(F)F)=CC(C(F)(F)F)=C1.SCC1=CC=CC=C1 ",
"input": "",
"output": " CC1=CC(C(=O)CC(SCC2=CC=CC=C2)(C2=CC(Cl)=CC(Cl)=C2)C(F)(F)F)=CC=C1C(=O)OC(C)(C)C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CC1=CC=CC=C1.COC(=O)C=P(C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1.O=CC1=CC2=CC(NC(=O)C3=CC4=CC=CC=C4O3)=CC=C2N1 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: COC(=O)C=CC1=CC2=CC(NC(=O)C3=CC4=CC=CC=C4O3)=CC=C2N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses COC1=CC=CC(S(=O)(=O)Cl)=C1.COC1=CC=CC(S(=O)(=O)NC2=CC=CC(C(=O)NC3=CC=C(C(=O)O)C=C3)=C2)=C1 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CCOC(=O)C1=CC=C(NC(=O)C2=CC=CC(NS(=O)(=O)C3=CC=CC(OC)=C3)=C2)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C=C(C)C.ClC(Cl)Cl.O.O=C1C2=C(O)C=CC=C2CC2=CC=CC(O)=C12.O=S(=O)(O)O ",
"input": "",
"output": " CC(C)(C)C1=CC=C2CC3=CC=CC(O)=C3C(=O)C2=C1O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CCN(CC1CCCC1)C1=NC2=C(C=C1C#N)N(C)C=C2.CN(C)C=O.O.O=C1CCC(=O)N1Br ",
"input": "",
"output": " CCN(CC1CCCC1)C1=NC2=C(C=C1C#N)N(C)C=C2Br ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. C.Cl.N#[N+]C1=CC=C(N)C=C1.NC1=CC=C(N)C=C1.O.O=N[O-].OC1=CC=CC=C1.[Na+].[OH-] ",
"input": "",
"output": " NC1=CC=C(N=NC2=CC=C(O)C=C2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. ClC1=CN=CC(Cl)=N1.OC1CCCC2=CC=CC=C21.[H-].[Na+] ",
"input": "",
"output": " ClC1=CN=CC(OC2CCCC3=CC=CC=C32)=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) BrB(Br)Br.CCCN1C(=O)C2=C(N=C(/C=C/C3=CC=C(OC)C(OC)=C3)N2C)N(CCC)C1=O.CO.ClCCl as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CCCN1C(=O)C2=C(N=C(/C=C/C3=CC=C(O)C(O)=C3)N2C)N(CCC)C1=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CN(C)C=O.CNC(=O)C1=CC=CC(O)=C1.C[Si](C)(C)[N-][Si](C)(C)C.NC1=CC(F)=CC=C1[N+](=O)[O-].O=C([O-])[O-].[K+] ",
"input": "",
"output": " CNC(=O)C1=CC(OC2=CC=C([N+](=O)[O-])C(NC)=C2)=CC=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. C1=CNC=N1.N#CC1=CC(F)=CC(C(F)(F)F)=C1 ",
"input": "",
"output": " N#CC1=CC(N2C=CN=C2)=CC(C(F)(F)F)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CCOC(=O)C1=CC(C(F)(F)F)=NN1C1CCN(C(=O)OC(C)(C)C)CC1.ClCCl.O=C(O)C(F)(F)F as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CCOC(=O)C1=CC(C(F)(F)F)=NN1C1CCNCC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) O=CC1=CC=CC=C1O.OC1=CC=C(Cl)C(F)=C1 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: O=CC1=CC(Cl)=C(F)C=C1O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1CCOC1.NO.O.O=S(=O)(/C=C/C1CCOCC1)N1CCN(C2=CC=C(OC(F)(F)C(F)F)C=C2)CC1 ",
"input": "",
"output": " O=S(=O)(CC(NO)C1CCOCC1)N1CCN(C2=CC=C(OC(F)(F)C(F)F)C=C2)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C1CCOC1.CC[C@@H](COC)OC1=CC(OCC2=CC=CC=C2)=CC(C(=O)NC2=NN(C)C=C2)=C1.CO.[Pd] .",
"input": "",
"output": " CC[C@@H](COC)OC1=CC(O)=CC(C(=O)NC2=NN(C)C=C2)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CN(CCCN)CCC(C1=CC=C(Cl)C=C1)C1=CC=CC=N1.N#CNC(=NCCSCC1=CSC(NC(=N)N)=N1)OC1=CC=CC=C1 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CN(CCCNC(=NCCSCC1=CSC(NC(=N)N)=N1)NC#N)CCC(C1=CC=C(Cl)C=C1)C1=CC=CC=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1=CC=C(P(C2=CC=CC=C2)[C-]2C=CC=C2)C=C1.C1COCCO1.CC(C)(C)[SiH2]OC(C)(C)C1=C(Br)C2=CC=CC=C2C(=O)O1.Cl[Pd]Cl.O.O=C([O-])[O-].OB(O)C1=CC=C(F)C(F)=C1.[Fe+2].[Na+] ",
"input": "",
"output": " CC(C)(C)[SiH2]OC(C)(C)C1=C(C2=CC=CC(F)=C2F)C2=CC=CC=C2C(=O)O1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCNCC1.CCO.O=CC1=CC=CC(O)=C1Cl.[BH4-].[Na+] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be OC1=CC=CC(CN2CCCCC2)=C1Cl .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC(C)C[C@@H](C(=O)NC1=NN(CC(C)(C)O)C=C1)N1CC(OC2=CC=CC=C2Cl)=CC1=O.CCC1=NSC(N)=N1.CCN=C=NCCCN(C)C.Cl.ClCCl.ON1N=NC2=CC=CC=C21 ",
"input": "",
"output": " CCC1=NSC(NC(=O)[C@H](CC(C)C)N2CC(OC3=CC=CC=C3Cl)=CC2=O)=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CCCCBr.CN1CCCC1.[F-].[K+] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CCC[N+]1(C)CCCC1.[Br-] .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CCO.CCOC(=O)CN1C=CC=C(OC)C1=O.NN.O , what product could potentially be produced?",
"input": "",
"output": "The product can be COC1=CC=CN(CC(=O)NN)C1=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1COCCN1.O.O=C([O-])O.O=S(Cl)Cl.O=[N+]([O-])C1=CC=C(CCS(=O)(=O)O)C=C1.[Na+] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " O=[N+]([O-])C1=CC=C(CCS(=O)(=O)N2CCOCC2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.CN(C)C=O.COC1=CC(C2=CC(C3=CC=CN=C3)=CN2)=CC(OC)=C1OC.COC1=CC=C(S(=O)(=O)Cl)C=C1 Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " COC1=CC=C(S(=O)(=O)N2C=C(C3=CC=CN=C3)C=C2C2=CC(OC)=C(OC)C(OC)=C2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CCOC(=O)CC(=O)CCC#N.N as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CCOC(=O)C=C(N)CCC#N .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC1=NC(C2=C(C3=CC=C(C(F)(F)F)C=C3)N(C)N=C2)=C2C(=O)NC=NN12.CN Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CN1N=CC(C2=C3C(N)=NC=NN3C=N2)=C1C1=CC=C(C(F)(F)F)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCNCC1.CN(C)C=O.COC1=CC2=C(C=C1OCCCOC1=CC3=C(C=C1OC)C(=O)N1C=C(C4=CC=C5OCOC5=C4)C[C@H]1C=N3)N=C[C@@H]1CC(C3=CC=C(NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)OCC4C5=CC=CC=C5C5=CC=CC=C54)C(C)C)C=C3)=CN1C2=O Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be COC1=CC2=C(C=C1OCCCOC1=CC3=C(C=C1OC)C(=O)N1C=C(C4=CC=C5OCOC5=C4)C[C@H]1C=N3)N=C[C@@H]1CC(C3=CC=C(NC(=O)[C@H](C)NC(=O)[C@@H](N)C(C)C)C=C3)=CN1C2=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)(C)OC(=O)NC1=NC2=CC=C(N)C=C2S1.CN(C)C=O.ClCCl.O.O=C(O)C(F)(F)F.O=C=NC1=CC=C(Cl)C(C(F)(F)F)=C1 Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be NC1=NC2=CC=C(NC(=O)NC3=CC=C(Cl)C(C(F)(F)F)=C3)C=C2S1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC(=O)O[BH-](OC(C)=O)OC(C)=O.CC(C)(C)OC(=O)N1CCNCC1.COC(OC)OC.ClCCCl.O=CC1=CC2=NC(Cl)=NC(N3CCOCC3)=C2S1.[Na+] , what product could potentially be produced?",
"input": "",
"output": "The product can be CC(C)(C)OC(=O)N1CCN(CC2=CC3=NC(Cl)=NC(N4CCOCC4)=C3S2)CC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C1=CC=C(CC2CCNC2)C=C1.CC(C)CCNC(=O)C1=CC=C(Cl)N=N1 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC(C)CCNC(=O)C1=CC=C(N2CCC(CC3=CC=CC=C3)C2)N=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CCO.COC1=CC=C(CN2C=NC3=C(N[C@@H](C)C4=CC5=CC=CC(Cl)=C5C(C#N)=N4)N=CN=C32)C=C1.Cl.NO.O.[Na+].[OH-] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " COC1=CC=C(CN2C=NC3=C(N[C@@H](C)C4=CC5=CC=CC(Cl)=C5C(/C(N)=N/O)=N4)N=CN=C32)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C1=C[N-]C=N1.CCN(CC)CC.CN(C)C=O.C[Si](C)(C)Cl.NC1=NN=NN1.O.O=C(N1C=CN=C1)N1C=CN=C1.O=C(O)C1=CN2C(=O)C3=C(N=C2C=C1)SC(C1=CC=CC=C1)=C3 , what product could potentially be produced?",
"input": "",
"output": "The product can be O=C(NC1=NN=NN1)C1=CN2C(=O)C3=C(N=C2C=C1)SC(C1=CC=CC=C1)=C3 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CN(C)C=O.CO.COC(=O)C1=CN([C@@H](CCC2=CC=CC=C2)CO[Si](C)(C)C(C)(C)C)C=N1.C[O-].Cl.N=C(N)N.O.[Na+] ",
"input": "",
"output": " N=C(N)NC(=O)C1=CN([C@H](CO)CCC2=CC=CC=C2)C=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. N#CC(C#N)=CC1=CC=C(Cl)C=C1Cl.N=C(N)C1=CC=CC=C1F ",
"input": "",
"output": " NCC1=C(N)N=C(C2=CC=CC=C2F)N=C1C1=CC=C(Cl)C=C1Cl ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CC(C)(C)[O-].CC1CCC=C[C@@H]2C[C@@]2(C(=O)NS(=O)(=O)C2(C)CC2)NC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](NC(=O)OC(C)(C)C)[C@H](C)C1.COC1=CC=C2C(Cl)=NC(N(C)C)=CC2=C1.CS(C)=O.[K+] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " COC1=CC=C2C(O[C@@H]3C[C@H]4C(=O)N[C@]5(C(=O)NS(=O)(=O)C6(C)CC6)C[C@H]5C=CCCC(C)C[C@@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N4C3)=NC(N(C)C)=CC2=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1CCOC1.CC1(C)CC(N)C2=CC(OCC3=CC=CC=C3)=CC=C2O1.CCN(CC)CC.CS(=O)(=O)Cl as the reactants and reagents.",
"input": "",
"output": " CC1(C)CC(NS(C)(=O)=O)C2=CC(OCC3=CC=CC=C3)=CC=C2O1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCO.C[C@@H]1CNC[C@H](C)N1.O=C(CCl)NC1=CC=CC=C1Cl.O=C([O-])O.[Na+] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " C[C@@H]1CN(CC(=O)NC2=CC=CC=C2Cl)C[C@H](C)N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC(=O)O[BH-](OC(C)=O)OC(C)=O.CN1CCNCC1.C[C@@H](CC=O)[C@H]1CC=C2C3=C(CC[C@@]21C)[C@@]1(C)CC[C@H](O)C(C)(C)C1CC3.[Na+] ",
"input": "",
"output": " C[C@@H](CCN1CCN(C)CC1)[C@H]1CC=C2C3=C(CC[C@@]21C)[C@@]1(C)CC[C@H](O)C(C)(C)[C@@H]1CC3 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC(=O)OC(C)C.COC(=O)[C@@H]1C[C@@H](S(=O)(=O)C2=CC=CC=C2C(F)(F)F)CN1C(=S)CC(C)=NN(C)C(=O)OC(C)(C)C.ClCCl.O=C(O)C(F)(F)F , what product could potentially be produced?",
"input": "",
"output": "The product can be COC(=O)[C@@H]1C[C@@H](S(=O)(=O)C2=CC=CC=C2C(F)(F)F)CN1C1=CC(C)=NN1C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CN(C)C=O.COCCl.OC1=CC2=C(C=C1Br)OCC2.[H-].[H][H].[Na+] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " COCOC1=CC2=C(C=C1Br)OCC2 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C1CCOC1.CC(=O)O.CN(C)C=O.CO.COC(=O)[C@@H](OC(C)(C)C)C1=C(C)C=C2N=C(C3=CC=NC(C4=NC=C5C(=N4)C(C)=NN5C)=C3)SC2=C1C1=CC=C(Cl)C=C1.[Na+].[OH-] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CC1=CC2=C(SC(C3=CC=NC(C4=NC=C5C(=N4)C(C)=NN5C)=C3)=N2)C(C2=CC=C(Cl)C=C2)=C1[C@H](OC(C)(C)C)C(=O)O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC(C)(C)OC(=O)CC(=O)C1=CC=CC(C2=CN=CC=N2)=C1.CC1=CC(NC(=O)OC(C)(C)C)=C(N)C=C1Cl is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC1=CC(NC(=O)OC(C)(C)C)=C(NC(=O)CC(=O)C2=CC=CC(C3=CN=CC=N3)=C2)C=C1Cl ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if COC(=O)C=CCCCCCC1=C(C2=CC=CN=C2)N(C)C2=CC=CC=C12.[Li+].[OH-] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CN1C(C2=CC=CN=C2)=C(CCCCCC=CC(=O)O)C2=CC=CC=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C1CCOC1.CN1CC(COC2=CC=CC3=C2CC=C3)OCC1=O.[Al+3].[H-].[Li+] , what product could potentially be produced?",
"input": "",
"output": "The product can be CN1CCOC(COC2=CC=CC3=C2CC=C3)C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)OC(=O)C(CC1=CC=C(N)C=C1)C(N)=O.ClC1=CC=CC(C2=CC(Cl)=C3CCCC3=N2)=C1 Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CC(C)OC(=O)C(CC1=CC=C(NC2=CC(C3=CC=CC(Cl)=C3)=NC3=C2CCC3)C=C1)C(N)=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC1=CC=CC=C1N1CNC(=O)C12CCN(C(=O)C1=CC(C(F)(F)F)=CC(C(F)(F)F)=C1)CC2.CN1C=CN=C1CCl is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC1=CC=CC=C1N1CN(CC2=NC=CN2C)C(=O)C12CCN(C(=O)C1=CC(C(F)(F)F)=CC(C(F)(F)F)=C1)CC2 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C1CCOC1.CN(C)CCN.O=C(N1C=CN=C1)N1C=CN=C1.O=C(O)C1=CC([N+](=O)[O-])=CC=C1Cl .",
"input": "",
"output": " CN(C)CCNC(=O)C1=CC([N+](=O)[O-])=CC=C1Cl ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1CCOC1.C=CCC1(C2=CC=C(F)C=C2)CCN([C@@H](C)C2=CC=CC=C2)C(=O)O1.CCOC(C)=O.O.O=[Os](=O)(=O)=O ",
"input": "",
"output": " C[C@@H](C1=CC=CC=C1)N1CCC(CCO)(C2=CC=C(F)C=C2)OC1=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC(=O)O.CC(=O)[O-].CC1=CC=CC=C1.CC1CC2=CC=CC=C2C1=O.N#CCC(=O)O.[NH4+] ",
"input": "",
"output": " CC1=C(CC(=O)O)C2=CC=CC=C2C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CCO.[N-]=[N+]=NCC1=CC=CC(N2CCCC2=O)=N1.[Pt] ",
"input": "",
"output": " NCC1=CC=CC(N2CCCC2=O)=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CCO.CNC1=NC(C2=CC(F)=C(C#N)C(OC)=C2)=CC(N2C[C@@H](C(=O)NCC3=CC=CC=C3)CC[C@H]2C)=N1.NN ",
"input": "",
"output": " CNC1=NC(C2=CC(OC)=C3C(N)=NNC3=C2)=CC(N2C[C@@H](C(=O)NCC3=CC=CC=C3)CC[C@H]2C)=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CCCCCCCCCCCCBr.CCO.NC1=CC=CC=C1S.O.[Na+].[OH-] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CCCCCCCCCCCCSC1=CC=CC=C1N .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC1=CC=CC=C1.CCCC(C)C.CCOCC.CN1C(=O)C2=C(C3=CC(Cl)=CC(C#N)=C3)N(CCSC(C3=CC=CC=C3)(C3=CC=CC=C3)C3=CC=CC=C3)C=C2N(C)C1=O.CO.O=CC1=CC=C(Cl)O1.O=S(=O)([O-])C(F)(F)F.[Bi+3] ",
"input": "",
"output": " CN1C(=O)C2=C(C3=CC(Cl)=CC(C#N)=C3)N3CCSC(C4=CC=C(Cl)O4)C3=C2N(C)C1=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CCCCN(CCCC)C(=O)Cl.O=C(Cl)C1=CC=CC=C1C(=O)Cl.O=C1OC(=O)C2=CC=CC=C12 as the reactants and reagents.",
"input": "",
"output": " CCCCN(C=O)CCCC ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCO.CCSC1=NC(N)=CC(C2=CC=C(Cl)C=C2Cl)=N1.O=C(CCl)CCl Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CCSC1=NC(C2=CC=C(Cl)C=C2Cl)=CC2=NC(CCl)=CN12 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C=CCN.CCOC(=O)C1=C[C@@H](OC(CC)CC)[C@H](N)[C@@H](OS(C)(=O)=O)C1.Cl .",
"input": "",
"output": " C=CCN[C@H]1CC(C(=O)OCC)=C[C@@H](OC(CC)CC)[C@@H]1N ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C=C(OCC)OCC.CCO.CCOC(=O)CC(C)=O.CCOC(C)=O.CC[O-].[Na+] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CCOC(=O)C(C(C)=O)=C(C)OCC .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C=CC1=CC(B2OC(C)(C)C(C)(C)O2)=CC(C(F)(F)F)=C1.CC(NC(=O)C1=CC=C(Br)O1)C1=CC(F)=C(NS(C)(=O)=O)C(F)=C1.Cl[Pd](Cl)([PH](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1)[PH](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1.O=C([O-])[O-].[Cs+] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be C=CC1=CC(C2=CC=C(C(=O)NC(C)C3=CC(F)=C(NS(C)(=O)=O)C(F)=C3)O2)=CC(C(F)(F)F)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. C1CCOC1.CC(=O)C(C)C.CC(C)(C)OC(=O)C(Cl)Cl ",
"input": "",
"output": " CC(C)C1(C)OC1(Cl)C(=O)OC(C)(C)C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CC=C(P(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.CC(C)(C)OC(=O)N=NC(=O)OC(C)(C)C.COC(=O)C1=C(O)C=C(N2C=NC3=CN=C(CO[Si](C)(C)C(C)(C)C)C=C32)S1.C[C@H](O)C1=CC=CC=C1Br.ClCCl Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be COC(=O)C1=C(O[C@H](C)C2=CC=CC=C2Br)C=C(N2C=NC3=CN=C(CO[Si](C)(C)C(C)(C)C)C=C32)S1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC1=C(CCC2=NC=C(C(=O)O)S2)C(C2=CC=CC=N2)=NO1.NC1CC1 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CC1=C(CCC2=NC=C(C(=O)NC3CC3)S2)C(C2=CC=CC=N2)=NO1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC(C)(C)OC(=O)CBr.CCN(CC)CC.CN(C)C=O.O.O=C1CNCC2=CC(Br)=CN=C2N1 as the reactants and reagents.",
"input": "",
"output": " CC(C)(C)OC(=O)CN1CC(=O)NC2=NC=C(Br)C=C2C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC(C)(C)[O-].CN(C)C=O.COC(=O)C1=CC=CC(O)=C1.FC(F)(F)C1=CC=C(Br)N=C1.O.[K+] .",
"input": "",
"output": " COC(=O)C1=CC=CC(OC2=CC=C(C(F)(F)F)C=N2)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CN(C)C=O.O=C(C1CC1)N1CC[C@@H](CC2=NNC(=O)N2C2=CC=C(C3=CC=C4OC=CC4=C3)C=C2)C1.O=C([O-])[O-].OCCCl.[K+] ",
"input": "",
"output": " O=C(C1CC1)N1CC[C@@H](CC2=NN(CCO)C(=O)N2C2=CC=C(C3=CC=C4OC=CC4=C3)C=C2)C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC1=NOC(C2=CC(C(=O)CC(=O)OC(C)(C)C)=CC=N2)=C1.COCCN(C)C1=CC(NC(=O)OC(C)(C)C)=C(N)C=C1Cl as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: COCCN(C)C1=CC(NC(=O)OC(C)(C)C)=C(NC(=O)CC(=O)C2=CC=NC(C3=CC(C)=NO3)=C2)C=C1Cl .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CC(=O)C(=CC1=CC=CC2=C1OC(C)=CC2=O)C(C)=O.CC(C)O.NC1=CC(=O)NC=N1 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CC(=O)C1=C(C)NC2=C(C(=O)NC=N2)C1C1=CC=CC2=C1OC(C)=CC2=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. COC1=CC=C(N=C=O)C=C1.NCC1=CN(C2=CC=CC=C2)C2=CC(Cl)=CC=C2C1=O ",
"input": "",
"output": " COC1=CC=C(NC(=O)NCC2=CN(C3=CC=CC=C3)C3=CC(Cl)=CC=C3C2=O)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1=CC=C(P(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.C1CCOC1.CC(C)(C)OC(=O)CN1C(S)=NC2=CC(F)=CC=C21.CC(C)(C)OC(=O)N=NC(=O)OC(C)(C)C.COC1=CC=C(C(=O)O)C=C1CO ",
"input": "",
"output": " CC(C)(C)OC(=O)CN1C(SCC2=CC=CC(C(=O)O)=C2)=NC2=CC(F)=CC=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C1=NC=C2NC=NC2=N1.CCCCCC.CCOC(C)=O.CN(C)C=O.CN[C@@H]1CCCC[C@H]1NC.IC1=CC=CC=C1.O=C([O-])[O-].[Cs+].[Cu]I is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " C1=CC=C(N2C=NC3=NC=NC3=C2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC1=C(Br)C=C(C(=O)O)N1.CC1=C(Cl)C(Cl)=C(C(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)N1 .",
"input": "",
"output": " CC1=C(Br)C=C(C(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C1CCOC1.CC(C)(C)OC(=O)OC(C)(C)C.CN(C)C1=CC=NC=C1.NC1=CC=CC(CN2CCNCC2)=N1 , what product could potentially be produced?",
"input": "",
"output": "The product can be CC(C)(C)OC(=O)N1CCN(CC2=CC=CC(N)=N2)CC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CC=NC=C1.CC(C)S(=O)(=O)C1=CC=C(C2=CN=C3NC=CC3=N2)C=C1.CCOC(C)=O.ClCCl.ClI Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CC(C)S(=O)(=O)C1=CC=C(C2=CN=C3NC=C(I)C3=N2)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC#N.CC(C)(C)OC(=O)OC(C)(C)C.CC1=CC2=CC(Br)=CC=C2N1.CCOC(C)=O.CN(C)C1=CC=NC=C1 Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CC1=CC2=CC(Br)=CC=C2N1C(=O)OC(C)(C)C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC1=CC(N2C[C@H](CNC(=O)C3=CC=C(Cl)S3)OC2=O)=CC(C)=C1N1C=CC=C(O)C1=O.CN1CCCC1=O.ClCCBr.O.O=C([O-])[O-].[Cs+] ",
"input": "",
"output": " CC1=CC(N2C[C@H](CNC(=O)C3=CC=C(Cl)S3)OC2=O)=CC(C)=C1N1C=CC=C(OCCCl)C1=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CCOC(=O)CBr.O=C(CNC(=O)C1=CC=C(Cl)C(Cl)=C1)C1=COC=C1.[H-].[Na+] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CCOC(=O)CC(NC(=O)C1=CC=C(Cl)C(Cl)=C1)C(=O)C1=COC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CN(C)C=O.ClCC1=CSC(C2=CC=C(Cl)C=C2)=N1.N#CC1=C(Cl)N=C2NC(=O)NC(=O)C2=C1C1=CC=CC=C1.O.O=C([O-])O.[Na+].[S-2] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: N#CC1=C(SCC2=CSC(C3=CC=C(Cl)C=C3)=N2)N=C2NC(=O)NC(=O)C2=C1C1=CC=CC=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CCOC(C)=O.COC(=O)C1=CC(C#N)=CC=C1O.O=[N+]([O-])O as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: COC(=O)C1=CC(C#N)=CC([N+](=O)[O-])=C1O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " COC(=O)C1=C(O)NC(C)=C(C(=O)OCCN2CCN(C(C3=CC=CC=C3)C3=CC=CC=C3)CC2)C1C1=CC=CC([N+](=O)[O-])=C1.O=P(Cl)(Cl)Cl Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be COC(=O)C1=C(Cl)NC(C)=C(C(=O)OCCN2CCN(C(C3=CC=CC=C3)C3=CC=CC=C3)CC2)C1C1=CC=CC([N+](=O)[O-])=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C1=CC=NC=C1.CC(=O)OC1(CCCO)CC2=CC=C(OC(C)CCCC3=CC=CC=C3)C=C2OC1(C)C.COC1=CC(CNCCCNCCCCNCCCN)=CC=C1O.CS(=O)(=O)Cl as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CC(=O)OC1(CCCOS(C)(=O)=O)CC2=CC=C(OC(C)CCCC3=CC=CC=C3)C=C2OC1(C)C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.CC1(C)OC2=CC=C(Br)C=C2C(=O)C1(CO)CO.C[Mg+].Cl.[Br-] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " C=C1C2=CC(Br)=CC=C2OC(C)(C)C1(CO)CO ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C=COCC.CC(=O)C(CCl)=NO.O=C([O-])[O-].[Na+] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CCOC1CCC(C(C)=O)=NO1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C1CCOC1.CO.O=C(NC1CCN(C2=NC=NC3=C2C(Br)=CN3S(=O)(=O)C2=CC=CC=C2)CC1)C1=CC=CC=C1.O=C([O-])[O-].[Cs+] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: O=C(NC1CCN(C2=NC=NC3=C2C(Br)=CN3)CC1)C1=CC=CC=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C(=NC1CCCCC1)=NC1CCCCC1.CO.ClCCl.O=C(O)C1CCCCC1(O)C(=O)C1=CC=CC=C1 Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be COC(=O)C1CCCCC1(O)C(=O)C1=CC=CC=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC1=NN(C)C(=O)C=C1O.O=P(Cl)(Cl)Cl as the reactants and reagents.",
"input": "",
"output": " CC1=NN(C)C(=O)C=C1Cl ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCO.CCOC(=O)C1CN(S(=O)(=O)C2=CC=C(C)C=C2)CCC1=O.CC[O-].NNC1=CC=CC=C1.O.[Cl-].[Na+] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CC1=CC=C(S(=O)(=O)N2CCC3=C(C2)C(=O)N(C2=CC=CC=C2)N3)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC1(C)COB(C2=CC=C(O)C=C2Cl)OC1.CCC1(CC)CN(CC2=CC(C3=CC=C(O)C(F)=C3)=NC3=C2C(C)=NN3)C(C)(C)CN1 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CCC1(CC)CN(CC2=CC(C3=CC=C(O)C=C3Cl)=NC3=C2C(C)=NN3)C(C)(C)CN1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CCOP(=O)(CC1=CC=CC=C1C)OCC.O.O=C([O-])[O-].O=S(=O)(O)O.O=[Mn](=O)(=O)[O-].[K+].[Na+] as the reactants and reagents.",
"input": "",
"output": " CCOP(=O)(CC1=CC=CC=C1C(=O)O)OCC ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C=CCC1=CC=C(O)C(OC)=C1.C=CCC1=CC=C(OC(C)=O)C(OC)=C1.CC(=O)OC(C)=O.C[SiH](C)Cl ",
"input": "",
"output": " COC1=CC(CCC[Si](C)(C)Cl)=CC=C1OC(C)=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses ClC(Cl)Cl.O.O=C1C(Cl)=C(OCC2=CC=C(Cl)C=C2)C=NN1CCCO.O=S(Br)Br as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: O=C1C(Cl)=C(OCC2=CC=C(Cl)C=C2)C=NN1CCCBr .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC1(C)C2=CC=CC(P(C3=CC=CC=C3)C3=CC=CC=C3)=C2OC2=C(P(C3=CC=CC=C3)C3=CC=CC=C3)C=CC=C21.COC1=CC=C(Cl)C(C2=CC(C)=C3N=C(N)N=NC3=C2)=C1.ClCCl.O=C(/C=C/C1=CC=CC=C1)/C=C/C1=CC=CC=C1.O=C([O-])[O-].O=S(=O)(NCCN1CCCC1)C1=CC=C(Br)C=C1.[Cs+].[Pd] , what product could potentially be produced?",
"input": "",
"output": "The product can be COC1=CC=C(Cl)C(C2=CC(C)=C3N=C(NC4=CC=C(S(=O)(=O)NCCN5CCCC5)C=C4)N=NC3=C2)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC1(C)C2=CC=CC(P(C3=CC=CC=C3)C3=CC=CC=C3)=C2OC2=C(P(C3=CC=CC=C3)C3=CC=CC=C3)C=CC=C21.COC1=CC=C(Cl)C(C2=CC(C)=C3N=C(N)N=NC3=C2)=C1.ClCCl.O=C(C=CC1=CC=CC=C1)C=CC1=CC=CC=C1.O=C([O-])[O-].O=S(=O)(NCCN1CCCC1)C1=CC=C(Br)C=C1.[Cs+].[Pd] ",
"input": "",
"output": " COC1=CC=C(Cl)C(C2=CC(C)=C3N=C(NC4=CC=C(S(=O)(=O)NCCN5CCCC5)C=C4)N=NC3=C2)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " BrBr.CC(=O)O.COC1=C(C)C=C(N)C(C)=C1C.N#C[S-].O.[K+].[Na+].[OH-] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " COC1=C(C)C(C)=C2N=C(N)SC2=C1C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CO.COC/C(=C/C(=O)NC1=CC=C(C2=CC=CC=C2S(N)(=O)=O)C=C1)C1=CC=CC(C(=N)N)=C1.[H][H].[Pd] ",
"input": "",
"output": " COCC(CC(=O)NC1=CC=C(C2=CC=CC=C2S(N)(=O)=O)C=C1)C1=CC=CC(C(=N)N)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if COC(=O)C1=CC=C(I)C=C1O.Cl.NO.[Na+].[OH-] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " O=C(NO)C1=CC=C(I)C=C1O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CNC=N1.CC(C)(C)[Si](Cl)(C1=CC=CC=C1)C1=CC=CC=C1.CN(C)C=O.COCC1=CC([N+](=O)[O-])=CC=C1N1C=CC=C(CCO)C1=O Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be COCC1=CC([N+](=O)[O-])=CC=C1N1C=CC=C(CCO[Si](C2=CC=CC=C2)(C2=CC=CC=C2)C(C)(C)C)C1=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. C1=CC=C([PH](C2=CC=CC=C2)(C2=CC=CC=C2)[Pd]([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)[PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.C1CCOC1.CCOC(=O)CCC[Zn+].COC1=CC=C(F)C(F)=C1COC1=CC([N+](=O)[O-])=C(Cl)C=C1Br.Cl.[Br-] ",
"input": "",
"output": " CCOC(=O)CCCC1=CC(Cl)=C([N+](=O)[O-])C=C1OCC1=C(OC)C=CC(F)=C1F ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC1=CC=CC=C1.CCOC(=O)C1=C(C)C(C2=CC=C(OCC3=C(N4N=NN(C)C4=O)C=CC=C3C3CC3)C(C)=C2)=NN1.COS(=O)(=O)OC.O ",
"input": "",
"output": " CCOC(=O)C1=C(C)C(C2=CC=C(OCC3=C(N4N=NN(C)C4=O)C=CC=C3C3CC3)C(C)=C2)=NN1C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) BrC1=NC=CS1.CC(C)(CC1=NC2=CC(OCC3=CC=C4C=CC=CC4=N3)=CC=C2N1CC1=CC=C(B2OC(C)(C)C(C)(C)O2)C=C1)C(=O)O as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CC(C)(CC1=NC2=CC(OCC3=CC=C4C=CC=CC4=N3)=CC=C2N1CC1=CC=C(C2=NC=CS2)C=C1)C(=O)O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C#CC1=CC=CC(N)=C1.CC1=C(CCCN2CCOCC2)C(C)=C(C=C2C(=O)NC3=NC=NC(Cl)=C23)N1.Cl as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: C#CC1=CC=CC(NC2=NC=NC3=C2C(=CC2=C(C)C(CCCN4CCOCC4)=C(C)N2)C(=O)N3)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1=CNN=C1.CCOC(C)=O.CN1CCCC1=O.CN[C@@H]1CCCC[C@H]1NC.COC1=CC(Br)=CC=C1N.O=C([O-])[O-].[Cl-].[Cu]I.[K+].[Na+] ",
"input": "",
"output": " COC1=CC(N2C=CC=N2)=CC=C1N ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) BrC1=CSC2=CC=NC=C12.C1CCCCC1.C1CCOC1.CC(C)NC(C)C.CI.[LiH] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CC1=C(Br)C2=CN=CC=C2S1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCC1=CC(C2=CC=C(S(=O)(=O)Cl)O2)=C(C)NC1=O.NCC1=CC=CN=C1 Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CCC1=CC(C2=CC=C(S(=O)(=O)NCC3=CC=CN=C3)O2)=C(C)NC1=O.Cl ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. C1=CC=NC=C1.C=CC(C)OC(=O)Cl.ClCCl.NC1=CN=C2NC(C3=CC=CC=C3)=NC2=C1.O ",
"input": "",
"output": " C=CC(C)OC(=O)NC1=CN=C2NC(C3=CC=CC=C3)=NC2=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CCOC(=O)C1=NN=C(N)S1.N#C[C@@H]1C[C@H](F)CN1C(=O)CNC12CCC(C(=O)O)(CC1)CC2 ",
"input": "",
"output": " CCOC(=O)C1=NN=C(NC(=O)C23CCC(NCC(=O)N4C[C@@H](F)C[C@H]4C#N)(CC2)CC3)S1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.CC(C)(C)OC(=O)N[C@H](CO)C(=O)O.CC1(C)CSC(C)(C)C1N.CCN(CC)CC.CCOC(=O)Cl.CCOC(C)=O Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CC(C)(C)OC(=O)N[C@H](CO)C(=O)NC1C(C)(C)CSC1(C)C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CCOC(=O)/C=C/C1=CC=C([Se]C2=CC=C3C(C4=CC=C(C)C=C4)=CCC(C)(C)C3=C2)C=C1.O.[Li+].[OH-] ",
"input": "",
"output": " CC1=CC=C(C2=CCC(C)(C)C3=CC([Se]C4=CC=C(/C=C/C(=O)O)C=C4)=CC=C23)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CN(C)C=O.N#CC1=CN=C(N2CCC(O)CC2)N=C1.[Cl-].[N-]=[N+]=[N-].[NH4+].[Na+].[OH-] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be OC1CCN(C2=NC=C(C3=NN=NN3)C=N2)CC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1COCCO1.CC(C)(C)OC(=O)N1CC=C(B2OC(C)(C)C(C)(C)O2)CC1.CC1=CC([N+](=O)[O-])=CC=C1Br.Cl[Pd](Cl)([PH](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1)[PH](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1.O=C([O-])[O-].[Na+] ",
"input": "",
"output": " CC1=CC([N+](=O)[O-])=CC=C1C1=CCN(C(=O)OC(C)(C)C)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC(=O)O.CCN(C(C)C)C(C)C.CCO.CS(=O)(=O)NC1=CC([C@@H](O)CNCCCCC2=CC=C(CCCCN)C=C2)=CC=C1O.CSC(=N)NC(=O)C1=NC(Cl)=C(N)N=C1N.I ",
"input": "",
"output": " CS(=O)(=O)NC1=CC([C@@H](O)CNCCCCC2=CC=C(CCCCNC(N)=NC(=O)C3=NC(Cl)=C(N)N=C3N)C=C2)=CC=C1O.[NH4+].[OH-] ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C1=CN=C2NN=CC2=C1.CN(C)C=O.C[Si](C)(C)CCOCCl.[H-].[Na+] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " C[Si](C)(C)CCOCN1N=CC2=CC=CN=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC(=O)N(C)C.CNC(=O)C1=CC=C(OCCCN)C=N1.ClC1=NC=NC2=C1C(C1=NC=CS1)=CS2.O=C(O)C(F)(F)F.O=C([O-])[O-].[K+] ",
"input": "",
"output": " CNC(=O)C1=CC=C(OCCCNC2=NC=NC3=C2C(C2=NC=CS2)=CS3)C=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC(C)(C)N=C=NC1=CC=CN=C1.CC1(N=C=NC2=CC=CN=C2)CCC1 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC1(NC(=NC#N)NC2=CC=CN=C2)CCC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses ClCCl.O.O=C(O)CS(=O)(=O)CC(=O)O.O=S(=O)(O)O.OO as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: O=C(CS(=O)(=O)CC(=O)OO)OO .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CCOCC.COC(=O)C1=CNC=C1.ClCCl.O.O=C(Cl)C1CCCCC1 , what product could potentially be produced?",
"input": "",
"output": "The product can be COC(=O)C1=CNC(C(=O)C2CCCCC2)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC#N.CC(C)(C)OC(=O)N[C@]1(C(=O)OC(C)(C)C)C[C@@]1(CN=[N+]=[N-])C1=CC=CC=C1.CC(C)(C)OC(=O)N[C@]1(C(=O)OC(C)(C)C)C[C@]1(CO)C1=CC=CC=C1.CC1=CC=C(S(=O)(=O)O)C=C1.O .",
"input": "",
"output": " CC(C)(C)OC(=O)[C@@]1(N)C[C@@]1(CN=[N+]=[N-])C1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCOC(=O)CN1CCC(CCC2=CC=C3C=CC=NC3=N2)C1=O.CO.[Pd] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CCOC(=O)CN1CCC(CCC2=CC=C3CCCNC3=N2)C1=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C=CCCC(C)(C)COC(=O)N[C@H](C(=O)O)C(C)(C)C.C=CCCC1(C(=O)OCC)CC1 ",
"input": "",
"output": " C=CCCC1(COC(=O)N[C@H](C(=O)O)C(C)(C)C)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCO.CN(C)C=O.COC1=CC2=NC=CC(OC3=CC=C(C)N=C3I)=C2C=C1OC.O.O=C([O-])[O-].OB(O)C1=CC=NC=C1.[K+] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " COC1=CC2=NC=CC(OC3=CC=C(C)N=C3C3=CC=NC=C3)=C2C=C1OC ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1=CC=NC=C1.CCC(=O)CBr.CCCC1=CC(C(N)=S)=CC=C1OCCCOC1=CC=C2C(=C1)C=CN2CC(=O)OC.CCO as the reactants and reagents.",
"input": "",
"output": " CCCC1=CC(C2=NC(CC)=CS2)=CC=C1OCCCOC1=CC=C2C(=C1)C=CN2CC(=O)OC ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1=CC=C(P(C2=CC=CC=C2)[C-]2C=CC=C2)C=C1.CC#N.CC(=O)[O-].C[C@H]1CN(C2COC2)CCN1C1=CC=C(NC2=CC(B3OC(C)(C)C(C)(C)O3)=CN(C)C2=O)N=C1.Cl[Pd]Cl.O.O=CC1=C(Cl)C=CN=C1N1N=CC2=C(SC3=C2CCCC3)C1=O.O=P([O-])([O-])[O-].[Fe+2].[K+].[Na+] ",
"input": "",
"output": " C[C@H]1CN(C2COC2)CCN1C1=CC=C(NC2=CC(C3=CC=NC(N4N=CC5=C(SC6=C5CCCC6)C4=O)=C3C=O)=CN(C)C2=O)N=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC1=CC=CC=C1C1=CC=C2C(Cl)=NN=CC2=C1.CCN(C(C)C)C(C)C.CN1CCCC1=O.ClC1=CC=C(C2COCCN2)C=C1.O=C([O-])[O-].[Na+] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CC1=CC=CC=C1C1=CC=C2C(N3CCOCC3C3=CC=C(Cl)C=C3)=NN=CC2=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C1CCNC1.C1CCOC1.Cl.ClCCl.O=C1C=C(C2=CC=C(C(F)(F)F)C=C2)C=CN1C1=CC=C2C(=C1)C=NN2C[C@H]1CO1 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " O=C1C=C(C2=CC=C(C(F)(F)F)C=C2)C=CN1C1=CC=C2C(=C1)C=NN2C[C@H](O)CN1CCCC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C1CCNC1.C1CCOC1.Cl.ClCCl.O=C1C=C(C2=CC=C(C(F)(F)F)C=C2)C=CN1C1=CC=C2C(=C1)C=NN2C[C@@H]1CO1 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " O=C1C=C(C2=CC=C(C(F)(F)F)C=C2)C=CN1C1=CC=C2C(=C1)C=NN2C[C@@H](O)CN1CCCC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1CCOC1.CC1(C2=CC=CC(N)=C2)C2CN(CC3=CC=CC=C3)C(=O)C21.Cl.O.[Al+3].[H-].[Li+].[Na+].[OH-] as the reactants and reagents.",
"input": "",
"output": " CC1(C2=CC=CC(N)=C2)C2CN(CC3=CC=CC=C3)CC21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C1=CC=CC=C1.O=C(O)CC(F)(F)C(=O)O.O=S(Cl)Cl as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: O=C1CC(F)(F)C(=O)O1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. C1CCOC1.CC#N.CCOC(C)=O.F[B-](F)(F)F.NC1=NC=CC=C1C(=O)NCC1=CC=C(OC2=CC=CC=C2)S1.O.O=C([O-])O.O=[N+]=O.[Na+] ",
"input": "",
"output": " CC(=O)NC1=NC=CC=C1C(=O)NCC1=CC=C(OC2=CC=CC=C2)S1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C1=CC=C(P(C2=CC=CC=C2)C2=CC=C3C=CC=CC3=C2C2=C3C=CC=CC3=CC=C2P(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.CC(C)(C)[O-].CC1=CC(C)=C(Br)C(C)=C1.CC1=CC=CC=C1.CNCCN.O=C(/C=C/C1=CC=CC=C1)/C=C/C1=CC=CC=C1.[Na+].[Pd] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CNCCNC1=C(C)C=C(C)C=C1C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CCCCC(=O)Cl.CCOC(=O)C(CC1=CC=CC=C1)OC1=CC=C2C=C(C3=CC4=CC=CC=C4O3)C=CC2=C1C.ClCCl.Cl[Sn](Cl)(Cl)Cl.O=C([O-])O.[Na+] ",
"input": "",
"output": " CCCCC(=O)C1=C(C2=CC=C3C(C)=C(OC(CC4=CC=CC=C4)C(=O)OCC)C=CC3=C2)OC2=CC=CC=C12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1CCOC1.CCOC(=O)C1=CC=C2N=C(N3C4CCC3CC(OCC3=C(C5CC5)ON=C3C3CC3C3=CC=CC=C3)C4)SC2=C1.CO.O.[Li+].[OH-] ",
"input": "",
"output": " O=C(O)C1=CC=C2N=C(N3C4CCC3CC(OCC3=C(C5CC5)ON=C3C3CC3C3=CC=CC=C3)C4)SC2=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC(=O)O.CN(C)C=O.COC(=O)C1=CC=C([N+](=O)[O-])C=N1.SCC1=CC=CC(Cl)=C1.[H-].[Na+] , what product could potentially be produced?",
"input": "",
"output": "The product can be COC(=O)C1=CC=C(SCC2=CC=CC(Cl)=C2)C=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CCCC1=C(O)C=CC=C1O.CN(C)C=O.O=C(CBr)C1=CC=CC=C1.O=C([O-])[O-].[Cs+] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CCCC1=C(O)C=CC=C1OCC(=O)C1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CO1.CCCCC1(C)CO1.NCCN.[C-]#[C-].[H-].[Li+].[Li]CCCC.[Na+] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " C#CCC(C)(O)CCCC ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CCC(=O)C1=C(O)CC(C2=C(C)C=C(C)C=C2C)CC1=O.CCON.CNC.Cl.O=S(=O)(O)Cl ",
"input": "",
"output": " CCON=C(CC)C1=C(O)CC(C2=C(C)C=C(C)C(S(=O)(=O)N(C)C)=C2C)CC1=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C1CCOC1.CCO.COC1=CC=C(OCC(=O)C2=CC=CC=C2)C([N+](=O)[O-])=C1.[Ni] .",
"input": "",
"output": " COC1=CC=C2OCC(C3=CC=CC=C3)NC2=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CCOC(=O)CN(C1=CC=C2C(C)=CC(CNC3=CC=C(C(=N)N)C=C3)=NC2=C1)S(=O)(=O)C1=CC=CC2=CC=CN=C12.[Na+].[OH-] .",
"input": "",
"output": " CC1=CC(CNC2=CC=C(C(=N)N)C=C2)=NC2=CC(N(CC(=O)O)S(=O)(=O)C3=CC=CC4=CC=CN=C34)=CC=C12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CN(C)CCNC1=NC2=CC3=C(C=C2[N+]([O-])=N1)CCCCC3.CO as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CN(C)CCNC1=N[N+]([O-])=C2C=C3CCCCCC3=CC2=[N+]1[O-] ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1COCCO1.COC1=CC(CCl)=CC(OC)=C1OC.COC1=CC2=C(C=C1OC)CCN=C2 ",
"input": "",
"output": " COC1=CC2=C(C=C1OC)CC[N+](CC1=CC(OC)=C(OC)C(OC)=C1)=C2.[Cl-] ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CCOP(=O)(CC1=CC=C(NC2=NC=C(C(F)(F)F)C(Cl)=N2)C=C1)OCC.COC1=CC=C(N)C2=C1CN(C)C2=O .",
"input": "",
"output": " CCOP(=O)(CC1=CC=C(NC2=NC=C(C(F)(F)F)C(NC3=CC=C(OC)C4=C3C(=O)N(C)C4)=N2)C=C1)OCC ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCC1=CC=C(CSC2=CN(COC)C(=O)C(OCOC)=C2)C=C1.ClCC1=CC=NC=C1 Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be COCOC1=CC(SCC2=CC=NC=C2)=CN(COC)C1=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC/C=C/C1(CCC(=O)CC)CC2=CC(OC)=CC=C2C1=O.CO.[Na+].[OH-] , what product could potentially be produced?",
"input": "",
"output": "The product can be CC/C=C/C12CCC(=O)C(C)=C1C1=CC=C(OC)C=C1C2 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C1CCOC1.CC#N.COC(=O)C1=CC(F)=NC=C1NC(=O)OC(C)(C)C , what product could potentially be produced?",
"input": "",
"output": "The product can be CC(C)(C)OC(=O)NC1=CN=C(F)C=C1C(=O)CC#N .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(=O)O.CCCCO.NC1=NC(C2=CC=CC=C2Cl)=NO1.[K+].[OH-] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CCCCOC1=NC(C2=CC=CC=C2Cl)=NN1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CO.NCCC1=CC=CC=C1.O=C/C=C1\\CCCC2=C1C=NN2C1=CC=CC=C1.[BH3-]C#N.[Na+] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CN(C/C=C1\\CCCC2=C1C=NN2C1=CC=CC=C1)CC1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC(C)(C)OC(=O)N1CCC[C@@H]1COC1=CC=C(O)C=C1.FC1=CC=C(CBr)C=C1 as the reactants and reagents.",
"input": "",
"output": " CC(C)(C)OC(=O)N1CCC[C@@H]1COC1=CC=C(OCC2=CC=C(F)C=C2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1=CC=NC=C1.C1CCOC1.CN(C)C=O.CO.NC1=NC2=CC=C(F)C=C2S1.O=C(Cl)C1=CCN(C2=NC=C(Br)C=C2F)CC1.O=C(O)C1=CCN(C2=NC=C(Br)C=C2F)CC1.O=S(Cl)Cl ",
"input": "",
"output": " O=C(NC1=NC2=CC=C(F)C=C2S1)C1=CCN(C2=NC=C(Br)C=C2F)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C1=CC=NC=C1.CC(C#CC1=C(C)C(=O)[C@@H](O)CC1(C)C)=CC=O.O.O=C(Cl)COC1=CC=CC=C1 .",
"input": "",
"output": " CC(C#CC1=C(C)C(=O)[C@@H](OC(=O)COC2=CC=CC=C2)CC1(C)C)=CC=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C(=NC1CCCCC1)=NC1CCCCC1.C1CCOC1.CCCCC(NC(=O)OCC1=CC=CC=C1)[PH](=O)O.CN(C)C1=CC=CC=N1.C[C@H](O)C(=O)N1CCC[C@H]1C(=O)OCC1=CC=CC=C1 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CCCCC(NC(=O)OCC1=CC=CC=C1)[PH](=O)OC(C)C(=O)N1CCC[C@H]1C(=O)OCC1=CC=CC=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.CC(=O)OC(C)=O.O=CO.O=S(=O)(CC(CCCC1=NC=CC=N1)NO)N1CCN(C2=CC=C(C#CC3=CC=C(C(F)(F)F)C=N3)C=N2)CC1 Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be O=CN(O)C(CCCC1=NC=CC=N1)CS(=O)(=O)N1CCN(C2=CC=C(C#CC3=CC=C(C(F)(F)F)C=N3)C=N2)CC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC1NC(=O)NN=C1C1=CC=C(N)C=C1.CN(C)C=O.CN=C=S is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CNC(=S)NC1=CC=C(C2=NNC(=O)NC2C)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) COC1=CC=CC=C1CCOC1=CC=CC2=C1C=C(C(=O)O)N2.C[C@H]1CN(CCC2(O)CCC(N)CC2)CC[C@@H]1O as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: COC1=CC=CC=C1CCOC1=CC=CC2=C1C=C(C(=O)NC1CCC(O)(CCN3CC[C@H](O)[C@@H](C)C3)CC1)N2 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCN(CC)CC.CCN(CC)CC(C)N.CCOC(C)=O.CN(C)C=O.COC1=CC2=NC=CC(OC3=CC=C(N)C(C)=C3C)=C2C=C1OC.S=C(Cl)Cl Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CCN(CC)CCCNC(=S)NC1=CC=C(OC2=CC=NC3=CC(OC)=C(OC)C=C23)C(C)=C1C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CC=NC=C1.CCOC(C)=O.ClCCl.O=C(Cl)C1=CC=CC=C1.O=C(NC1=NC2=CC=CC(C(=O)NC3=NC4=C(CNCC4)S3)=C2N1)C1=CC2=CC=CC=C2C=N1 Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be O=C(NC1=NC2=C(C(=O)NC3=NC4=C(CN(C(=O)C5=CC=CC=C5)CC4)S3)C=CC=C2N1)C1=CC2=CC=CC=C2C=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. Cl.N#C[S-].O=C(O)C1=CC=C(CNC2=CC=C(Cl)C=C2)C=C1.[K+] ",
"input": "",
"output": " NC(=S)N(CC1=CC=C(C(=O)O)C=C1)C1=CC=C(Cl)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)CCCBr.CC1=C(F)C(N)=C2C(=O)C=C(C3=CC=C(NC(=O)C(C)(C)C)C(F)=C3)OC2=C1F.[H-].[Na+] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CC1=C(F)C(NCCCC(C)C)=C2C(=O)C=C(C3=CC=C(NC(=O)C(C)(C)C)C(F)=C3)OC2=C1F .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC(C)=O.CC1=CC=C(S(=O)(=O)O)C=C1.CCOC(C)=O.COC(=O)C1=C(CC2=CC=CC=C2)CS[C@@H]2C(NC(C3=CC=CC=C3)(C3=CC=CC=C3)C3=CC=CC=C3)C(=O)N12 ",
"input": "",
"output": " COC(=O)C1=C(CC2=CC=CC=C2)CS[C@@H]2C(N)C(=O)N12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C1COCCO1.IC1=CC=CC=C1.O=C1C=C(O)C=CN1CCC1=CC=C(CN2CCCC2)C=C1.O=CO as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " O=C1C=C(OC2=CC=CC=C2)C=CN1CCC1=CC=C(CN2CCCC2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CCCC[N+](CCCC)(CCCC)CCCC.CN(C)C=O.N#CCCCCCCBr.O=C1N[C@@H](COC2CCCCO2)CS1.[Cl-].[H-].[I-].[NH4+].[Na+] as the reactants and reagents.",
"input": "",
"output": " N#CCCCCCCN1C(=O)SC[C@@H]1COC1CCCCO1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CCOC(=N)C1=CC=C2NN=C(C3=CC=C(F)C=C3)C2=C1.CO.C[O-].NNC(=O)COCC1=CC=CC=C1.[Na+] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: FC1=CC=C(C2=NNC3=CC=C(C4=NC(COCC5=CC=CC=C5)=NN4)C=C23)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1=CC=C(CN2CCC3(CC2)CNC3)C=C1.CCN=C=NCCCN(C)C.CN1CCOCC1.ClCCl.O=C(O)CN1CCC(C2=CC=C(F)C=C2)(C2=CC=C(F)C=C2)C1=O ",
"input": "",
"output": " O=C(CN1CCC(C2=CC=C(F)C=C2)(C2=CC=C(F)C=C2)C1=O)N1CC2(CCN(CC3=CC=CC=C3)CC2)C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC1=CC=CC(Cl)=C1CN.CCOC(=O)C1=CN2C=C(Br)C=CC2=N1 Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CC1=CC=CC(Cl)=C1CNC(=O)C1=CN2C=C(Br)C=CC2=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCO.O=C(O)C1=CC=C(I)C=C1.O=S(Cl)Cl Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CCOC(=O)C1=CC=C(I)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C1CCOC1.CCCCN1C2=C(NC=N2)C(=O)N2C=NN=C12.O=C1CCC(=O)N1Br .",
"input": "",
"output": " CCCCN1C2=C(NC(Br)=N2)C(=O)N2C=NN=C12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CC=C(NC2=CC=CC=C2)C=C1.CC1(C)OCC(Br)(OC2=CC=CC=C2)C(C)(C)O1.CCC1(CC)C2=CC(Br)=CC=C2C2=CC=C(Br)C=C21.NC1=CC=CC=C1 Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CCC1=CC2=C(CC3=CC(Br)=CC=C32)C(CC)=C1C=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CCSC1=CC=CC=C1C1=CN2C=C(C(F)(F)F)C=CC2=N1.ClC(Cl)Cl.O=C(OO)C1=CC=CC(Cl)=C1.O=S([O-])([O-])=S.[Na+] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CCS(=O)(=O)C1=CC=CC=C1C1=CN2C=C(C(F)(F)F)C=CC2=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using NC1=CC(Cl)=CC(Cl)=N1.O.O=N[O-].O=S(=O)(O)O.[Na+] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " OC1=CC(Cl)=CC(Cl)=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC1=NN(C2=CC(OS(C)(=O)=O)=C(Cl)C=C2F)C(C)=C1.ClC(Cl)Cl.ClCl , what product could potentially be produced?",
"input": "",
"output": "The product can be CC1=NN(C2=CC(OS(C)(=O)=O)=C(Cl)C=C2F)C(C)=C1Cl .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CCCC1=NC(S)=C2C=CC=CC2=N1.CI.O.[Na+].[OH-] ",
"input": "",
"output": " CCCC1=NC(SC)=C2C=CC=CC2=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC1=CC(NC2=CC3=CC(C(=O)O)=CC=C3C(OC(C)C)=N2)=NN1.CC1CNCC(C)N1 as the reactants and reagents.",
"input": "",
"output": " CC1=CC(NC2=CC3=CC(C(=O)N4CC(C)NC(C)C4)=CC=C3C(OC(C)C)=N2)=NN1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCN(CC)C(=O)C1=CC=CC=C1SC1=C(C(=O)OCC2=CC=C([N+](=O)[O-])C=C2)N2C(=O)[C@H]([C@@H](C)O[Si](C)(C)C)[C@H]2[C@H]1C.ClCCl.O=C(OO)C1=CC=CC(Cl)=C1.O=C([O-])O.[Na+] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CCN(CC)C(=O)C1=CC=CC=C1S(=O)C1=C(C(=O)OCC2=CC=C([N+](=O)[O-])C=C2)N2C(=O)[C@H]([C@@H](C)O[Si](C)(C)C)[C@H]2[C@H]1C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CN(CC1=CC=CC=C1)C1COCCN(C(=O)OC(C)(C)C)C1.CO.O=CO.[Pd] .",
"input": "",
"output": " CNC1COCCN(C(=O)OC(C)(C)C)C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CCO.Cl.NC(N)=O.O=C(CC1=CC=CC=C1)C1=CC=CC=C1.O=CC1=CC(OCCO)=C(O)C([N+](=O)[O-])=C1 ",
"input": "",
"output": " O=C1NC(C2=CC=CC=C2)=C(C2=CC=CC=C2)C(C2=CC(OCCO)=C(O)C([N+](=O)[O-])=C2)N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC(C)(C)OC(=O)N1CC[C@@H](CN(CC2=CC=CC=C2)CC2=CC=CC=C2)[C@H](O)C1.CC(C)O , what product could potentially be produced?",
"input": "",
"output": "The product can be O[C@@H]1CNCC[C@H]1CN(CC1=CC=CC=C1)CC1=CC=CC=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " COC(=O)C[C@H]1CCCN(C(=O)OC(C)(C)C)[C@@H]1C1=CC=C(C(F)(F)F)C=C1.ClCCl.O=C(O)C(F)(F)F Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " COC(=O)C[C@H]1CCCN[C@@H]1C1=CC=C(C(F)(F)F)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with COC1=CC=C(C2=NN(C3CCNCC3)C(=O)C2(C)C)C=C1OC.Cl.O=C(Cl)C1=CC=CC([N+](=O)[O-])=C1 as the reactants and reagents.",
"input": "",
"output": " COC1=CC=C(C2=NN(C3CCN(C(=O)C4=CC=CC([N+](=O)[O-])=C4)CC3)C(=O)C2(C)C)C=C1OC ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC1=NOC(C)=C1CN1C=C(N2C(=O)NC(C)(C)C2=O)C=N1.FC1=CC=C(CBr)C=C1 ",
"input": "",
"output": " CC1=NOC(C)=C1CN1C=C(N2C(=O)N(CC3=CC=C(F)C=C3)C(C)(C)C2=O)C=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. BrCCC1=CC=CC=C1.CC1=CC=C(NN)C=C1.CCN(CC)CC.CCO.Cl.O=C1CCN(C2CC2)CC1 ",
"input": "",
"output": " CC1=CC=C2C(=C1)C1=C(CCN(C3CC3)C1)N2CCC1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CC1=CC(C)=C(N)C(C)=C1.CCN(CC)CC.CCOCC.O=S(=O)(Cl)OCCBr as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " C=CS(=O)(=O)NC1=C(C)C=C(C)C=C1C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CCCN(C1=NN(C2=C(Cl)C=C(Cl)C=C2Cl)NC(Cl)=C1)C(C1CC1)C1CC1.CCOC(C)=O.CN(C)C=O.C[S-].O.[Na+] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CCCN(C1=NN(C2=C(Cl)C=C(Cl)C=C2Cl)NC(SC)=C1)C(C1CC1)C1CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC(C)(C)OC(=O)N1N=C(C2=CC=CC=C2Cl)C2=CN=C(OC3=CC=C(F)C=C3F)C=C21.CO.C[O-].[Na+] ",
"input": "",
"output": " FC1=CC=C(OC2=CC3=C(C=N2)C(C2=CC=CC=C2Cl)=NN3)C(F)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C1CCOC1.CC(C)[N-]C(C)C.CC1CCCCC1=O.C[Si](C)(C)Cl.[Li+] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CC1CCCC=C1O[Si](C)(C)C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC1=CSC(C(=O)NN)=N1.CC[O+](CC)CC.ClCCl.F[B-](F)(F)F.O=C1CN(C(=O)C2=CC=C(Cl)C(F)=C2Cl)CCN1 .",
"input": "",
"output": " CC1=CSC(C2=NN=C3CN(C(=O)C4=CC=C(Cl)C(F)=C4Cl)CCN32)=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C1CCOC1.CCOC(=O)C1=C(C)N2C=CC3=C(OCCN3C(=O)OC(C)(C)C)C2=N1.O.O=S(=O)([O-])[O-].[Al+3].[H-].[Li+].[Na+] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC1=C(CO)N=C2C3=C(C=CN12)N(C(=O)OC(C)(C)C)CCO3 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1COCCO1.COC1=CC(F)=CC2=CC=C(C)N=C12.O.O=[Se]=O ",
"input": "",
"output": " COC1=CC(F)=CC2=CC=C(C=O)N=C12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC(C)(CN)CO.CCOC(=O)C1=C(O)C2=NC=C(CC3=CC=C(F)C=C3)C=C2N(CC(=O)N2CCCC2)C1=O ",
"input": "",
"output": " CC(C)(CO)CNC(=O)C1=C(O)C2=NC=C(CC3=CC=C(F)C=C3)C=C2N(CC(=O)N2CCCC2)C1=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C=CC1=NC=CC=C1[N+](=O)[O-].CCO.[H][H].[Pd] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CCC1=NC=CC=C1N ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C=CC(Cl)CCl.Cl[SiH](Cl)Cl as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " ClCC(Cl)CC[Si](Cl)(Cl)Cl ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1CCOC1.CC(C)=O.CC1=NC2=CC=C3CCC(=O)C3=C2O1.N#CI ",
"input": "",
"output": " CC(C)=C1CC2=CC=C3N=C(C)OC3=C2C1=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC#N.CCN(C(C)C)C(C)C.CCOC(=O)C=C(CBr)OC1=CC(F)=CC=C1F.COC(=O)[C@@H](N)CC(C)C.Cl , what product could potentially be produced?",
"input": "",
"output": "The product can be COC(=O)[C@H](CC(C)C)N1CC(OC2=CC(F)=CC=C2F)=CC1=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C=CC1=CC=CC(C(F)(F)F)=C1.CC(C)(C)OC(N)=O.CC1(C)C(=O)N(Cl)C(=O)N1Cl.CCCO.CC[C@@H]1CN2CC[C@@H]1C[C@@H]2[C@H](OC1=NN=C(O[C@H](C2=CC=NC3=CC=C(OC)C=C23)[C@H]2C[C@@H]3CCN2C[C@@H]3CC)C2=CC=CC=C12)C1=CC=NC2=CC=C(OC)C=C12.O=S([O-])[O-].[Na+].[OH-] ",
"input": "",
"output": " CC(C)(C)OC(=O)N[C@H](CO)C1=CC=CC(C(F)(F)F)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC(C)(C)OC(=O)CCC1=CC=C(O)C=C1CN.CC(C)OC(=O)Cl.CCN(CC)CC.ClCCl is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC(C)OC(=O)NCC1=CC(O)=CC=C1CCC(=O)OC(C)(C)C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CCOCC.NC1=CC=C2OCC(=O)NC2=C1.O=C(O)C(=O)N1CCC(CC2=CC=C(F)C=C2)CC1 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " O=C1COC2=CC=C(NC(=O)C(=O)N3CCC(CC4=CC=C(F)C=C4)CC3)C=C2N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC(C)(C)OC(=O)N1CCC(O)(C2=CC3=CC=CC(F)=C3O2)CC1.CCO.[Pd] .",
"input": "",
"output": " CC(C)(C)OC(=O)N1CCC(O)(C2CC3=CC=CC(F)=C3O2)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CCO.CN(C)S(=O)(=O)CCCN.CO.O=CC1=CC2=NC(Cl)=NC(N3CCOCC3)=C2S1.[Pd] as the reactants and reagents.",
"input": "",
"output": " CN(C)S(=O)(=O)CCCNCC1=CC2=NC(Cl)=NC(N3CCOCC3)=C2S1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " O=C([C@H]1CC[C@H](O)CC1)N1CCN(C2CCC2)CC1.OC1=CC=C(Cl)N=C1 Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be O=C([C@H]1CC[C@@H](OC2=CC=C(Cl)N=C2)CC1)N1CCN(C2CCC2)CC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CC1=CC2=C(C=C1C)NC(S)=N2.CCN(CC)CC.CN(C)C=O.N#CC1=CC=CC=C1CBr.O as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CC1=CC2=C(C=C1C)NC(SCC1=CC=CC=C1C#N)=N2 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC1=CC=C(S(=O)(=O)N2C=C(C)C3=C(C4=NC5=C(CN(C6=CC(C(C)C)=CC=C6C)CC5)C(N5CCN[C@H](C)C5)=N4)C=CC=C32)C=C1.CCN(C(C)C)C(C)C.CCOC(C)=O.CS(=O)(=O)Cl.ClCCl Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CC1=CC=C(S(=O)(=O)N2C=C(C)C3=C(C4=NC5=C(CN(C6=CC(C(C)C)=CC=C6C)CC5)C(N5CCN(S(C)(=O)=O)[C@H](C)C5)=N4)C=CC=C32)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCCCCC.CCOC(=O)C(=O)Cl.CCOC(C)=O.CSC1=CC=CC=C1Cl.ClC(Cl)Cl.[Al+3].[Cl-] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CCOC(=O)C(=O)C1=CC=C(SC)C(Cl)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if Br.CCCCCCCCC1C(=O)NC(=O)NC1=O.O is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CCCCCCCCC1(Br)C(=O)NC(=O)NC1=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC(=O)[O-].CC1=CC=C(S(=O)(=O)Cl)C=C1.CCOCOCC.CN(C)C=O.CN1C(=O)NC(=O)C2=C1N=CN2.[Na+] as the reactants and reagents.",
"input": "",
"output": " CCOCN1C=NC2=C1C(=O)NC(=O)N2C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1CCOC1.O=C(C(F)(F)F)C(F)(F)F.O=C(O)C1=CC=C(Br)O1.[Li]CCCC ",
"input": "",
"output": " CCCCC(=O)C1=CC=C(C(O)(C(F)(F)F)C(F)(F)F)O1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C=C(C)CCl.CC1=CC=CC=C1.CN(C)C=O.COC1=CC=C(Br)C=C1O.O=C([O-])[O-].[K+] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " C=C(C)COC1=CC(Br)=CC=C1OC ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C1=CC=NC=C1.C1CCOC1.CCOC(C)=O.COC(=O)Cl.NC1=CC=C(CN2CCC(C(O)(C3=CC=C(OC(F)(F)F)C=C3)C3=CC=C(OC(F)(F)F)C=C3)CC2)C=C1.[Cl-].[Na+] , what product could potentially be produced?",
"input": "",
"output": "The product can be COC(=O)NC1=CC=C(CN2CCC(C(O)(C3=CC=C(OC(F)(F)F)C=C3)C3=CC=C(OC(F)(F)F)C=C3)CC2)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC(NC(=O)OC(C)(C)C)C1=CC=CC(C(=O)O)=C1.CCN(C(C)C)C(C)C.CCN=C=NCCCN(C)C.CCOC(C)=O.CN(C)C=O.CN[C@H](CC1=CC=C2C=CC=CC2=C1)C(=O)N(C)CCC1=CC=CS1.Cl.ClCCl.ON1N=NC2=CC=CN=C21 , what product could potentially be produced?",
"input": "",
"output": "The product can be CC(NC(=O)OC(C)(C)C)C1=CC=CC(C(=O)N(C)[C@H](CC2=CC=C3C=CC=CC3=C2)C(=O)N(C)CCC2=CC=CS2)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CCCC[Sn](CCCC)(CCCC)C1=CSC(OC)=N1.O=[N+]([O-])C1=C(Cl)SC=C1 ",
"input": "",
"output": " COC1=NC(C2=C([N+](=O)[O-])C=CS2)=CS1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CCOCC.COC(=O)[C@H]1O[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O.ClCCl.FB(F)F.OCC(Cl)(Cl)Cl .",
"input": "",
"output": " COC(=O)[C@H]1O[C@H](OCC(Cl)(Cl)Cl)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC(C)(C)C1=CC=CC=C1S.N#CC1=CC=C([N+](=O)[O-])C=C1C#N as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CC(C)(C)C1=CC=CC=C1SC1=CC=CC(C#N)=C1C#N .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CCCCCCC.C[Al](C)C.Cl.ClCCl.N#N.O=CC1=NOC(CN2C=C([N+](=O)[O-])C=N2)=C1.[Cl-].[NH4+] as the reactants and reagents.",
"input": "",
"output": " CC(O)C1=NOC(CN2C=C([N+](=O)[O-])C=N2)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC(C)NC1=CC=C(F)C=C1.CC1=CC=CC=C1.CCN(CC)CC.ClCCl.O=CC1=CC=C(C2=CC=C(CO)S2)C=C1 as the reactants and reagents.",
"input": "",
"output": " CC(C)N(CC1=CC=C(C2=CC=C(C=O)C=C2)S1)C1=CC=C(F)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. BrB(Br)Br.COC1=CC2=C3C(=C1)C[C@@H](C1=CC=CC=C1)C[C@H]3[C@H](N)CC2.ClCCl ",
"input": "",
"output": " Br.N[C@@H]1CCC2=CC(O)=CC3=C2[C@H]1C[C@H](C1=CC=CC=C1)C3 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C(=NC1CCCCC1)=NC1CCCCC1.CN(C)C1=CC=NC=C1.COCOC1=C(C)C=C(/C=C/C2=CC=CC(C(=O)O)=C2)C=C1C.ClCCl.SC1=CC=CC=C1 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: COCOC1=C(C)C=C(/C=C/C2=CC=CC(C(=O)SC3=CC=CC=C3)=C2)C=C1C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC(=O)Cl.CC1=NN=C2C=CC(C3=CC=CC(NC(C)C)=C3)=NN12.CCN(C(C)C)C(C)C.ClCCl.O .",
"input": "",
"output": " CC1=NN=C2C=CC(C3=CC=CC(CC(=O)NC(C)C)=C3)=NN12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CO.C[Si](C)(C)C=[N+]=[N-].ClCCl.O=C(O)C1=CC=C(Cl)N=C1OCC(F)F Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " COC(=O)C1=CC=C(Cl)N=C1OCC(F)F ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CN(C)C=O.C[C@@H]1O[C@@]1(CN1C=NC=N1)C1=CC=C(F)C=C1F.FC1=CC=C(C2=CNN=C2)C=C1.O=C([O-])[O-].[Ca+2] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " C[C@@H](N1C=C(C2=CC=C(F)C=C2)C=N1)[C@](O)(CN1C=NC=N1)C1=CC=C(F)C=C1F ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CCOC(C)=O.CN(C)C=O.COCCBr.O.O=C([O-])[O-].O=[N+]([O-])C1=CC=CC=C1S(=O)(=O)NCCN1CCS(=O)(=O)CC1.[Cs+] .",
"input": "",
"output": " COCCN(CCN1CCS(=O)(=O)CC1)S(=O)(=O)C1=CC=CC=C1[N+](=O)[O-] ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CC(C)C[C@@H](C(=O)O)N(C)CC1=C(C=O)OC2=CC=CC(Cl)=C2C1.ClCCl.NC1=CC=CC=N1.O.ON1N=NC2=CC=CC=C21 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CC(C)CC(C(=O)NC1=CC=CC=N1)N1CC2=C(OC3=CC=CC(Cl)=C3C2)C1=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: NC(N)=O.NC1=CC(Cl)=NC(Cl)=C1N.O , what product could potentially be produced?",
"input": "",
"output": "The product can be O=C1NC2=CC(Cl)=NC(Cl)=C2N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC1=CC=C(CSC[C@H](NC(=O)[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)O)C(=O)N[C@H](CO)[C@@H](C)O)C=C1.CCOCC.CSC1=CC=CC=C1.ClCCl.O=C(O)C(F)(F)F , what product could potentially be produced?",
"input": "",
"output": "The product can be CC1=CC=C(CSC[C@H](NC(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@H](CO)[C@@H](C)O)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. ClCCl.O=C(NC1=CC=CC(C(F)(F)F)=C1)C1=CC=CC=C1NCC1=CC=NC=C1.O=C(OO)C1=CC=CC(Cl)=C1 ",
"input": "",
"output": " O=C(NC1=CC=CC(C(F)(F)F)=C1)C1=CC=CC=C1NCC1=CC=[N+]([O-])C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC1(C)OB(C2=CN=CN=C2)OC1(C)C.CC1=CC(I)=CC(C)=C1Br.CN(C)C=O.O=C([O-])[O-].[Na+] ",
"input": "",
"output": " CC1=CC(C2=CN=CN=C2)=CC(C)=C1Br ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC(=O)O.COC1=NC=C(C2=CN(COCC[Si](C)(C)C)C3=NC=NC(N[C@@H](C)C4=NN5C=CC(C)=C5C(=O)N4C4=CC=CC=C4)=C23)C=C1N.O.[K+].[N-]=C=O is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " COC1=NC=C(C2=CN(COCC[Si](C)(C)C)C3=NC=NC(N[C@@H](C)C4=NN5C=CC(C)=C5C(=O)N4C4=CC=CC=C4)=C23)C=C1NC(N)=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CCOC(=O)CN(CCN(CCN(CC(=O)O)CC(=O)O)CC(=O)O)CC(=O)O.CO.NC1=CC=CC=C1 ",
"input": "",
"output": " O=C(O)CN(CCN(CC(=O)O)CC(=O)O)CCN(CC(=O)O)CC(=O)NC1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CC(C)(C)[PH]([Pd][PH](C(C)(C)C)(C(C)(C)C)C(C)(C)C)(C(C)(C)C)C(C)(C)C.CC1=CC(SCC=C(C2=CC=C(Br)C=C2)C2=CC=C(Br)C=C2)=CC=C1OCC(=O)O.O=C(/C=C/C1=CC=CC=C1)/C=C/C1=CC=CC=C1.OB(O)C1=CC=C(C2=CC=CC=C2)C=C1.[F-].[K+].[Pd] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CC1=CC(SCC=C(C2=CC=C(Br)C=C2)C2=CC=C(C3=CC=C(C4=CC=CC=C4)C=C3)C=C2)=CC=C1OCC(=O)O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC1=NC([N+](=O)[O-])=CN1.CI.CN(C)C=O.O.O=C([O-])[O-].[K+] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CC1=NC([N+](=O)[O-])=CN1C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CCN(C(C)C)C(C)C.CN(C)C=O.COC(=O)[C@@H](N)[C@@H](C)O.Cl.ClCCCl.O=C(O)C1=CC=C(CN2C=NC3=CC=CC=C32)C=C1.ON1N=NC2=CC=CC=C21 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: COC(=O)[C@@H](NC(=O)C1=CC=C(CN2C=NC3=CC=CC=C32)C=C1)[C@@H](C)O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CO.COC(=O)NC1=NC2=C(OC)C=CC(C3=CCN(C(=O)OC(C)(C)C)CC3)=C2S1.Cl as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: COC(=O)NC1=NC2=C(OC)C=CC(C3=CCNCC3)=C2S1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C1=CC=C(C2=CC=CC=C2P(C2CCCCC2)C2CCCCC2)C=C1.C1COCCO1.CSC1=NC=CC(C2=CC=CN=C2OC2=CC=C(Cl)N=C2)=N1.C[Si](C)(C)[N-][Si](C)(C)C.O=C(/C=C/C1=CC=CC=C1)/C=C/C1=CC=CC=C1.[Li+].[Pd] , what product could potentially be produced?",
"input": "",
"output": "The product can be CSC1=NC=CC(C2=CC=CN=C2OC2=CC=C(N)N=C2)=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCOC(C)=O.N#CC(C1=CC=C(Cl)C=C1)C1=C(Cl)C=C(NN)C=C1Cl.O=CC1=CC=CC=C1.O=S(=O)([O-])[O-].[Mg+2] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be N#CC(C1=CC=C(Cl)C=C1)C1=C(Cl)C=C(NN=CC2=CC=CC=C2)C=C1Cl .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " BrB(Br)Br.CCCCCCC.CCC[C@@H](CNC(=O)C1=NC(Cl)=C(N)N=C1N)[N+](C)(C)CCCC1=CC=C(OC)C=C1.ClCCl.O=C([O-])C(F)(F)F Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CCC[C@@H](CNC(=O)C1=NC(Cl)=C(N)N=C1N)[N+](C)(C)CCCC1=CC=C(O)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC(C)(COS(=O)(=O)CCCCl)[C@@H](OCC1=CC=CC=C1)C(=O)OCOC(=O)CC1=CC=CC=C1.CS(C)=O.[N-]=[N+]=[N-].[Na+] .",
"input": "",
"output": " CC(C)(COS(=O)(=O)CCCN=[N+]=[N-])[C@@H](OCC1=CC=CC=C1)C(=O)OCOC(=O)CC1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C1=CC=C(P(C2=CC=CC=C2)[C-]2C=CC=C2)C=C1.C1COCCO1.CC(=O)NC1=CN2N=C(Cl)C=CC2=N1.CC1(C)OC(C2=CN=C(Cl)C(N)=C2)OC1(C)C.Cl[Pd]Cl.O.O=C([O-])[O-].[Fe+2].[Na+] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CC(=O)NC1=CN2N=C(C3=CN=C(Cl)C(N)=C3)C=CC2=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CCCCC(Br)(CCCC)C1=CC=C(F)C=C1.CCOC(C)=O.ClCCl.O=C(OO)C1=CC=CC(Cl)=C1.O=S([O-])[O-].[Na+] .",
"input": "",
"output": " O=S(=O)=C(Br)C1=CC=C(F)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C1CCOC1.CC(C)/N=C(/NC(C)C)OC(C)(C)C.CC1(C)OB(C2=CC=C(CC(=O)O)C=C2)OC1(C)C , what product could potentially be produced?",
"input": "",
"output": "The product can be CC(C)(C)OC(=O)CC1=CC=C(B2OC(C)(C)C(C)(C)O2)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C1=NC=C2NC=NC2=N1.C1CN2CCN1CC2.CC(=O)O.CS(C)=O.OCC1=CC=CC=C1.[H-].[Na+] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " NC1=NC(OCC2=CC=CC=C2)=C2N=CNC2=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C=CCN1N=C(C(=O)OCC)C=C1OCCCN1CCN(C2=CC=CC3=C2C=CS3)CC1.CN.CO .",
"input": "",
"output": " C=CCN1N=C(C(=O)NC)C=C1OCCCN1CCN(C2=CC=CC3=C2C=CS3)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCC(C)=O.CCOC(=O)C(Cl)CCCl.NC1=CC(S)=C(Cl)C=C1F.O=C([O-])[O-].[K+] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CCOC(=O)C(CCCl)SC1=CC(N)=C(F)C=C1Cl .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C(=NC1CCCCC1)=NC1CCCCC1.CC(=O)C1=CC=C(O)C=C1.CC(C)(C)OC(=O)N1[C@@H](C(=O)O)COC1(C)C.CCOC(C)=O.CN(C)C1=CC=CC=N1 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC(=O)C1=CC=C(OC(=O)[C@H]2COC(C)(C)N2C(=O)OC(C)(C)C)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC#N.CC(C)(C)OC(=O)C1=CC=C(NCCN)C=C1.CCN(C(C)C)C(C)C.CN1C=NC(S(=O)(=O)Cl)=C1.O=S(=O)(Cl)Cl is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CN1C=NC(S(=O)(=O)NCCNC2=CC=C(C(=O)OC(C)(C)C)C=C2)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " COC1=CC=C(CC2C3=CC(OC)=C(OC)C=C3CCCN2C(C(=O)O)C2=CC=CC=C2)C=C1OC.Cl.NCC1=CNC2=CC=CC=C12 Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be COC1=CC=C(CC2C3=CC(OC)=C(OC)C=C3CCCN2C(C(=O)NCC2=CNC3=CC=CC=C23)C2=CC=CC=C2)C=C1OC .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CC(=O)N(C)C.CCOC(=O)C1=CN=C2C=CC(C3=CN=C4C=CC=CC4=C3)=NC2=C1Cl.NC1CCN(C(=O)OCC2=CC=CC=C2)CC1.O=C([O-])[O-].[K+] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " COC(=O)C1=CN=C2C=CC(C3=CN=C4C=CC=CC4=C3)=NC2=C1NC1CCN(C(=O)OCC2=CC=CC=C2)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C=CC[C@@H](NNC(=O)C1=CC=CC(OC)=C1C)C1CCCCC1.CC1=CC(C)=CC(C(=O)Cl)=C1.ClCCl.O.O=C([O-])[O-].[K+] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " C=CC[C@H](C1CCCCC1)N(NC(=O)C1=CC=CC(OC)=C1C)C(=O)C1=CC(C)=CC(C)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CCOC(=O)C1=CC2=C(C(F)(F)F)C=CC(N(C)CCOS(C)(=O)=O)=C2N1.CN(C)C=O.O.[H-].[Na+] .",
"input": "",
"output": " CCOC(=O)C1=CC2=C(C(F)(F)F)C=CC3=C2N1CCN3C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C=CC(OC)OC.CC1=CC(COC2=CC=C(C=NO)C=C2)=C2C=CC=CC2=N1 ",
"input": "",
"output": " COC(OC)C1CC(C2=CC=C(OCC3=CC(C)=NC4=CC=CC=C34)C=C2)=NO1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CCO.CNN.COC1=CC=C(C2=CC(=O)OC2O)C=C1 as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " COC1=CC=C(C2=CC(=O)N(C)N=C2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)Br.O=C(C1=CC=CC=C1)C1=CN=C2C(C(F)(F)F)=CC=CC2=C1C1=CC=CC(O)=C1 Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CC(C)OC1=CC=CC(C2=C3C=CC=C(C(F)(F)F)C3=NC=C2C(=O)C2=CC=CC=C2)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CCCC[N+](CCCC)(CCCC)CCCC.ClCCl.O.O=S(=O)([O-])O.OC(C1=CC=C(Br)S1)C(F)(F)F.[NaH] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " O=C(C1=CC=C(Br)S1)C(F)(F)F ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C[Si](C)(C)CCOCN1N=C(C=NN2C=CC=C2)C2=CC=C(NC3=CC=CC=C3C(=O)NCC#CC3CC3)C=C21.NC1=CC=CC(N)=C1.O as the reactants and reagents.",
"input": "",
"output": " O=C(NCC#CC1CC1)C1=CC=CC=C1NC1=CC=C2C(C=NN3C=CC=C3)=NNC2=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC(C)(C)OC(=O)N1C[C@H](O[Si](C)(C)C(C)(C)C)C[C@H]1C(C)(C)O.CC1=CC=CC=C1.CCN(CC)CC.O=S(Cl)Cl .",
"input": "",
"output": " C=C(C)[C@@H]1C[C@@H](O[Si](C)(C)C(C)(C)C)CN1C(=O)OC(C)(C)C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CN(C)C=O.CN1CCC(=O)CC1.OCCI is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " C[N+]1(CCO)CCC(=O)CC1.[I-] ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCCCCCCCCCCCC1=CC=C(C=O)S1.Cl.O.O=[Mn](=O)(=O)[O-].[K+].[Na+].[OH-] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CCCCCCCCCCCCC1=CC=C(C(=O)O)S1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCN(CCNC(=O)CN(CC(=O)N(C)N1CC2=CC=CC=C2C1)C1=CC=C(B2OCC(C)(C)CO2)C=C1C)C(=O)OC(C)(C)C.COC1=CC=C(Cl)N=N1 Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CCN(CCNC(=O)CN(CC(=O)N(C)N1CC2=CC=CC=C2C1)C1=CC=C(C2=CC=C(OC)N=N2)C=C1C)C(=O)OC(C)(C)C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1=CC=C([PH](C2=CC=CC=C2)(C2=CC=CC=C2)[Pd]([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)[PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.COCCOC.O=C(NC1=CC=NN=C1)C1=CC(Br)=CC=C1OCC1=CC=CC=C1.O=C([O-])[O-].OB(O)C1=CC=NC=C1.[Na+] as the reactants and reagents.",
"input": "",
"output": " O=C(NC1=CC=NN=C1)C1=CC(C2=CC=NC=C2)=CC=C1OCC1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. C#CCC(CCCC)(O[Si](C)(C)C)C(F)F.CC(C)(C#N)N=NC(C)(C)C#N.CCCC[SnH](CCCC)CCCC ",
"input": "",
"output": " CCCCC(C/C=C/[Sn](CCCC)(CCCC)CCCC)(O[Si](C)(C)C)C(F)F ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1=CC=C([PH](C2=CC=CC=C2)(C2=CC=CC=C2)[Pd]([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)[PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.C1COCCO1.COC1=CC(S(C)(=O)=O)=CC=C1B1OC(C)(C)C(C)(C)O1.FC1=CC=C(Br)C=C1I.O.O=C([O-])[O-].[Na+] ",
"input": "",
"output": " COC1=CC(S(C)(=O)=O)=CC=C1C1=CC(Br)=CC=C1F ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CC(=O)O.CN1CCN(CCCNC2=NC=C3C=C(C4=C(Cl)C=CC=C4Cl)C(N)=NC3=N2)CC1.CO.COC1=CC=C(N=C=O)C=C1 as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " COC1=CC=C(NC(=O)NC2=NC3=NC(NCCCN4CCN(C)CC4)=NC=C3C=C2C2=C(Cl)C=CC=C2Cl)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(O)CO.CCCCCCCCCCCCCCCCNC1=CC=C(CCC(=O)O)C=C1.CCOCC.FB(F)F Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CCCCCCCCCCCCCCCCNC1=CC=C(C=CC(=O)OCC(C)O)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CCOC(=O)C1=CC=CC(OCC2OCCO2)=C1.CO.C[Si](C)(C)N=[N+]=[N-].Cl[Sn](Cl)(Cl)Cl as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CCOC(=O)C1=CC=CC(OCC(N=[N+]=[N-])OCCO)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(=O)NC1=CC=C(CCCl)C=C1C.CI Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CC(=O)N(C)C1=CC=C(CCCl)C=C1C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1=CC=C(CN2CCNCC2)C=C1.CCCC(SC1=CC(C(C)(C)C)=C(O)C(C(C)(C)C)=C1)C(=O)O as the reactants and reagents.",
"input": "",
"output": " CCCC(SC1=CC(C(C)(C)C)=C(O)C(C(C)(C)C)=C1)C(=O)N1CCN(CC2=CC=CC=C2)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CC(N)C1=CC2=NC=C(F)C=C2N=C1C1=CC=CC=C1S(C)(=O)=O.CCCCO.CCN(C(C)C)C(C)C.N#CC1=C(N)N=CN=C1Cl.O as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CC(NC1=NC=NC(N)=C1C#N)C1=CC2=NC=C(F)C=C2N=C1C1=CC=CC=C1S(C)(=O)=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC1=CC=CC=C1.CCCC1C=CC2=C(O1)C(F)=C(F)C1=C2C=C(C)O1.[Pd] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CCCC1CCC2=C(O1)C(F)=C(F)C1=C2C=C(C)O1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " Br[Mg]C1CC1.C1CCOC1.O=CC1=CC=CC(C2=CC3=CC(C4=CC=C(Cl)C=C4)=NN3C=C2)=C1 Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " OCC1(C2=CC=CC(C3=CC4=CC(C5=CC=C(Cl)C=C5)=NN4C=C3)=C2)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CCCCC/C=C\\C/C=C\\C/C=C\\C/C=C\\CCCCN.CN(C)C=O.ClCCl.O=C(Cl)C(=O)Cl.O=C(O)C(F)(F)F as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " O=C([O-])C(F)(F)F ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CC(=O)[O-].CC1=CC=[N+](C)C2=CC=CC=C12.CCO.COC1=CC(C=O)=CC(OC)=C1O.O=C(O)C1=CC=CC=C1.[I-].[NH4+] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " COC1=CC(C=CC2=CC=[N+](C)C3=CC=CC=C23)=CC(OC)=C1OC(=O)C1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CCCCS(=O)(=O)Cl.ClCCl.FC1=CC=C(NCC2=CC=CN=C2)C(F)=C1.O=C([O-])O.O=C([O-])[O-].[K+].[Na+].[OH-] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CCCCS(=O)(=O)N(CC1=CC=CN=C1)C1=CC=C(F)C=C1F .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)(C)C(=N)N.Cl.ClCCl.ClSC(Cl)(Cl)Cl.O.[Na+].[OH-] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CC(C)(C)C1=NSC(Cl)=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if Br[Mg]C1CCCC1.C1CCOC1.COC1=CC=C2C=C(C(=O)C3=CNC=N3)C=CC2=C1 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " COC1=CC=C2C=C(C(O)(C3=CNC=N3)C3CCCC3)C=CC2=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CCN(CC)CC.ClCCl.O.O=C(Cl)OC1=CC=C([N+](=O)[O-])C=C1.O=C(NC1CNCC(C2=CC=C(OC(F)(F)F)C=C2)C1)C1=CC=CC=C1.O=C([O-])O.[Na+] ",
"input": "",
"output": " O=C(NC1CC(C2=CC=C(OC(F)(F)F)C=C2)CN(C(=O)OC2=CC=C([N+](=O)[O-])C=C2)C1)C1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) BrC1=CN=C(Br)C=N1.C1=CC=C([PH](C2=CC=CC=C2)(C2=CC=CC=C2)[Pd]([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)[PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.C1COCCO1.CC1(C)OB(C2=CC=C(N(C3=CC=CC=C3)C3=CC=CC4=CC=CC=C34)C=C2)OC1(C)C.O.O=C([O-])[O-].[K+] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: BrC1=CN=C(C2=CC=C(N(C3=CC=CC=C3)C3=CC=CC4=CC=CC=C34)C=C2)C=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)(C)[O-].CN(C)C=O.COC(=O)C1=CC=C(C2=CC=C(OC)C(C3=CC=C(C(F)(F)F)C=C3CBr)=C2)C(C)=C1.C[C@H]1C[C@@H](C2=CC(C(F)(F)F)=CC(C(F)(F)F)=C2)OC(=O)N1.[K+] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be COC(=O)C1=CC=C(C2=CC=C(OC)C(C3=CC=C(C(F)(F)F)C=C3CN3C(=O)O[C@H](C4=CC(C(F)(F)F)=CC(C(F)(F)F)=C4)C[C@@H]3C)=C2)C(C)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C1=CC=C([PH](C2=CC=CC=C2)(C2=CC=CC=C2)[Pd]([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)[PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.C1COCCO1.C=C(C)[C@@H]1CC[C@]2(N)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC=C(OS(=O)(=O)C(F)(F)F)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]12.COC(=O)C1CC=C(B2OC(C)(C)C(C)(C)O2)CC1.O.O=C([O-])[O-].[Na+] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " C=C(C)[C@@H]1CC[C@]2(N)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC=C(C6=CCC(C(=O)OC)CC6)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC1=CC=C(C#N)C=C1.CCO.Cl is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CCOC(=N)C1=CC=C(C)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C[Si](C)(C)N[Si](C)(C)C.ClC(C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1.NC1=NC2=C(NC=N2)C(=O)N1 ",
"input": "",
"output": " NC1=NC2=C(N=CN2C(C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C(=O)N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. C1COCCO1.CC(=O)CCC1=CC=C2C(=C1)COC1=CC=C(OCC3=CC=C4C=C(F)C(Cl)=CC4=N3)C=C1C2OC1CCCCO1.CC(=O)O.O.O=C(O)C(F)(F)F ",
"input": "",
"output": " CC(=O)CCC1=CC=C2C(=C1)COC1=CC=C(OCC3=CC=C4C=C(F)C(Cl)=CC4=N3)C=C1C2O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC1=CC=CC=C1.CC1=NOC(NC(=O)OC2=CC=CC=C2)=C1.CCN(C(C)C)C(C)C.COCCOC1=CC2=NC=CC(OC3=CC=C(N)C=C3)=C2C=C1C#N , what product could potentially be produced?",
"input": "",
"output": "The product can be COCCOC1=CC2=NC=CC(OC3=CC=C(NC(=O)NC4=CC(C)=NO4)C=C3)=C2C=C1C#N .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1CCOC1.CCN(CC)CC.COC[C@H](C)OC1=CC(OC2=CC=C(S(C)(=O)=O)C=C2)=CC(C2=CC=C(C(=O)NC[C@H](O)C(F)(F)F)N2)=C1.CS(=O)(=O)O.O=C([O-])O.[Na+] ",
"input": "",
"output": " COC[C@H](C)OC1=CC(OC2=CC=C(S(C)(=O)=O)C=C2)=CC(C2=CC=C(C3=NC[C@H](C(F)(F)F)O3)N2)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C1CCOC1.COC(=O)CN1C(=O)C=CC2=CC(OC(F)(F)F)=CC=C21.Cl.O.[Li+].[OH-] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: O=C(O)CN1C(=O)C=CC2=CC(OC(F)(F)F)=CC=C21 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(=O)NC1=CC=C(NC(C)=O)C(F)=C1.CC(=O)O.O=[N+]([O-])O Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CC(=O)NC1=CC([N+](=O)[O-])=C(NC(C)=O)C=C1F ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C1CCC2=NCCCN2CC1.CC1=CC(N=O)=CC(C)=C1O.ClCCl.O=CC1=CC=CC=C1 as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CC1=CC(N(O)C(=O)C2=CC=CC=C2)=CC(C)=C1O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1=CC=C([As](C2=CC=CC=C2)C2=CC=CC=C2)C=C1.CC1=CC=CC=C1.CCCC[Sn](CCCC)(CCCC)C1=CC=CS1.CN(C)[C@@H]1C(O)=C(C(N)=O)C(=O)[C@@]2(O)C(O)=C3C(=O)C4=C(O)C(NC(=O)CN5CCCCO5)=CC(I)=C4C[C@H]3C[C@@H]12.CN(C)[C@@H]1C(O)=C(C(N)=O)C(=O)[C@@]2(O)C(O)=C3C(=O)C4=C(O)C=CC=C4[C@@](C)(O)[C@H]3C[C@@H]12.Cl[Pd](Cl)([PH](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1)[PH](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1.[Cu]I ",
"input": "",
"output": " CN(C)[C@@H]1C(O)=C(C(N)=O)C(=O)[C@@]2(O)C(O)=C3C(=O)C4=C(O)C(NC(=O)CN5CCCCO5)=CC(C5=CC=CS5)=C4C[C@H]3C[C@@H]12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CO.Cl.O.O=C1C2=CC(Cl)=CC=C2CCC1CN1CCC2(CC1)C(=O)NCN2C1=CC=CC=C1.[BH4-].[Na+] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be O=C1NCN(C2=CC=CC=C2)C12CCN(C[C@@H]1CCC3=CC=C(Cl)C=C3[C@H]1O)CC2 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(=O)OCCN1C(=O)C(=CC2=CC(C(C)(C)C)=C(O)C(C(C)(C)C)=C2)SC1=S.CC(C)(C#N)N=NC(C)(C)C#N.CC1=CC=CC=C1.CCCC[SnH](CCCC)CCCC Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CC(=O)OCCN1CSC(=CC2=CC(C(C)(C)C)=C(O)C(C(C)(C)C)=C2)C1=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC1(C)OC2=CC=C(C#N)C=C2C2OC21.COC(=O)NN as the reactants and reagents.",
"input": "",
"output": " COC(=O)NN[C@@H]1C2=CC(C#N)=CC=C2OC(C)(C)[C@H]1O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CNC.CS(=O)NC1=CN=C(Cl)N=C1 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CN(C)S(C)(=O)=NC1=CN=C(Cl)N=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C=CCBr.CC(=O)N(C)C.CCOC(=O)C1=CC=C(NC2=CC=C3C(=C2)C(C(C)(C)C)=CCC3(C)C)C=C1.CCOCC.O=C([O-])[O-].[K+] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: C=CCN(C1=CC=C(C(=O)OCC)C=C1)C1=CC=C2C(=C1)C(C(C)(C)C)=CCC2(C)C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC(=O)N(C)C.CC(C)C1=CC(C(C)C)=C(C2=CC=CC=C2P(C2CCCCC2)C2CCCCC2)C(C(C)C)=C1.COC1=NC2=CC=C(C(O)(C3=CN=NN3C)C3=CN=C(C)N3C)C=C2C(Cl)=C1CC1=CC=C(C(F)(F)F)C=C1.O=C(/C=C/C1=CC=CC=C1)/C=C/C1=CC=CC=C1.[C-]#N.[Pd].[Zn+2].[Zn] .",
"input": "",
"output": " COC1=NC2=CC=C(C(O)(C3=CN=NN3C)C3=CN=C(C)N3C)C=C2C(C#N)=C1CC1=CC=C(C(F)(F)F)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CCCCC(Br)C(=O)OCC.CCN(CC)CC.CN(C)C=O.COC1=NC(N)=C(Cl)C=C1C(=O)NCC1CCNCC1.O.[I-].[Na+] ",
"input": "",
"output": " CCCCC(C(=O)OCC)N1CCC(CNC(=O)C2=CC(Cl)=C(N)N=C2OC)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if ClC1=CC=C(C(Cl)(Cl)Cl)C=C1.ClC1=CC=C(C(Cl)(Cl)Cl)C=C1Cl.ClSSCl.O=S(=O)(Cl)Cl.[Al+3].[Cl-] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " ClC1=CC(Cl)=C(C(Cl)(Cl)Cl)C=C1Cl ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC(=NO)C(C)(C)COC1=CC=C(F)C=C1.CC1=C(C2(C3=CC(Br)=C(O)C(Br)=C3C)OS(=O)(=O)C3=CC=CC=C32)C=C(Br)C(O)=C1Br.CO.Cl.[BH3-]C#N.[Na+] ",
"input": "",
"output": " CC(NO)C(C)(C)COC1=CC=C(F)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CN1CCC(C2=CNC3=CC=C(N)C=C23)CC1.O=C(O)C1CC1 ",
"input": "",
"output": " CN1CCC(C2=CNC3=CC=C(NC(=O)C4CC4)C=C23)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CC(C)(SC1=NC(CC(=O)O)=CS1)C(=O)O.CC(C)N=C=NC(C)C.CCOC(=O)CC1=CC=C(N)C=C1.CN(C)C=O.O.ON1N=NC2=CC=CC=C21 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CCOC(=O)CC1=CC=C(NC(=O)CC2=CSC(SC(C)(C)C(=O)O)=N2)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC(C)OC1=CC=C(S(C)(=O)=O)C=C1C(=O)N1CCC(OS(C)(=O)=O)CC1.CN(C)C=O.N#CC1=CC=C(O)C=C1.[H-].[Na+] , what product could potentially be produced?",
"input": "",
"output": "The product can be CC(C)OC1=CC=C(S(C)(=O)=O)C=C1C(=O)N1CCC(OC2=CC=C(C#N)C=C2)CC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC1=CN=C2C(O)=CC=CC2=C1.N.O.O=S([O-])[O-].[NH4+] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CC1=CN=C2C(N)=CC=CC2=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC(=O)[O-].CN(C)C=O.O.O=C(N1C=CN=C1)N1C=CN=C1.O=C(O)CN1CCC2=CC(OCC3=CC=CC(F)=C3)=CC=C2C1=O.[NH4+] .",
"input": "",
"output": " NC(=O)CN1CCC2=CC(OCC3=CC=CC(F)=C3)=CC=C2C1=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC1=CC=C(CCC2=CC3=C(NC(=O)CN=C3C3=CC=CC=C3Cl)S2)C=C1.CC1=CC=CC=C1.COC1=CC=C(P2(=S)SP(=S)(C3=CC=C(OC)C=C3)S2)C=C1 ",
"input": "",
"output": " CC1=CC=C(CCC2=CC3=C(NC(=S)CN=C3C3=CC=CC=C3Cl)S2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C=CCN1CC(=O)N2[C@@H](CC3=CC=C(OCC4=CC=CC=C4)C=C3F)C(=O)N(CC3=CC=CC(F)=N3)C[C@@H]2N1C(=O)NCC1=CC=CC=C1.CSC1=CC=CC=C1.O=C(O)C(F)(F)F is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " C=CCN1CC(=O)N2[C@@H](CC3=CC=C(O)C=C3F)C(=O)N(CC3=CC=CC(F)=N3)C[C@@H]2N1C(=O)NCC1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CCSCC=C1OC2CC(=O)N2C1C(=O)OCC1=CC=CC=C1.ClCCl.O=C(OO)C1=CC=CC(Cl)=C1 ",
"input": "",
"output": " CCS(=O)CC=C1OC2CC(=O)N2C1C(=O)OCC1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C1=CC=NC=C1.C1CCOC1.C=C(C)CCl.CC#N.CC1=CC=CC=C1.CCCC[N+](CCCC)(CCCC)CCCC.CCO.ClCCl.O.O=C([O-])[O-].O=S(=O)([O-])O.O=S([O-])S(=O)[O-].O=[N+]([O-])C1=CC=C(F)C=C1O.[K+].[Na+] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: C=C(C)COC1=CC(F)=CC=C1NC(C)=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC(=CCO)C1=CC2=CC(C3=CC=CC=C3)=CC=C2OC1.ClCCl.[Mn+4].[O-2] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CC(=CC=O)C1=CC2=CC(C3=CC=CC=C3)=CC=C2OC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C1=CC=C(P(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.C1CCOC1.O=C1C2=CC=CC=C2C(=O)N1O.OC1C=CCCC1 , what product could potentially be produced?",
"input": "",
"output": "The product can be O=C1C2=CC=CC=C2C(=O)N1OC1C=CCCC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC(=O)O[C@H]1CC[C@@]2(C)C(=CC[C@@H]3[C@@H]2[C@@H](O)C[C@]2(C)C(=O)[C@H]4C[C@H]4[C@@H]32)C1.CC1=CC(C)=NC(C)=C1.CCOC(C)=O.CN(C)C=O.CS(=O)(=O)Cl.O=S=O as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CC(=O)O[C@H]1CC[C@@]2(C)C(=CC[C@@H]3C2=CC[C@]2(C)C(=O)[C@H]4C[C@H]4[C@@H]32)C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1CN2CCC(CC2)N1.CC(C)O.CSC1=NC2=CC(Br)=CC=C2O1 ",
"input": "",
"output": " BrC1=CC=C2OC(N3CCN4CCC3CC4)=NC2=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC1=C(CCCS(=O)(=O)C2=CC=CC=C2)C2=CC=CC=C2N1.CCC(C)=O.ClC1=CC=C2C(C3CCNCC3)=NOC2=C1.O.O=C([O-])[O-].[K+] ",
"input": "",
"output": " CC1=C(CCCN2CCC(C3=NOC4=CC(Cl)=CC=C34)CC2)C2=CC=CC=C2N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1COCCO1.CC1=CC(F)=NC=C1B(O)O.CCOC(C)=O.CN(C)C1=CC=C(P(C(C)(C)C)C(C)(C)C)C=C1.Cl[Pd]Cl.NC1=CC2=CC=C(Br)C=C2C=N1.O.O=C([O-])[O-].[K+] as the reactants and reagents.",
"input": "",
"output": " CC1=CC(F)=NC=C1C1=CC=C2C=C(N)N=CC2=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C1COCCO1.CCS(=O)(=O)N1CCNCC1.NS(N)(=O)=O as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CCS(=O)(=O)N1CCN(S(N)(=O)=O)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C1=CC=C([PH](C2=CC=CC=C2)(C2=CC=CC=C2)[Pd]([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)[PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.CC1=C(C(=O)NCC2=CC=CC=C2)SC(Br)=N1.CC1=CC=CC=C1.CCCCCC.CCO.O.O=C([O-])[O-].OB(O)C1=CC=NN1.[K+] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CC1=C(C(=O)NCC2=CC=CC=C2)SC(C2=CC=NN2)=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC1=CC=CC(C)=C1.CCOC(C)=O.COC(=O)C1=CC=NC(Cl)=C1.C[Sn](C)(C)C1=CC=CC=N1.Cl[Pd](Cl)([PH](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1)[PH](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1.O , what product could potentially be produced?",
"input": "",
"output": "The product can be COC(=O)C1=CC=NC(C2=CC=CC=N2)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CCO.CC[O-].NC(=S)NNC(=O)C1=CC=CC=C1.[K+].[KH].[Na+].[OH-] , what product could potentially be produced?",
"input": "",
"output": "The product can be S=C1N=NC(C2=CC=CC=C2)=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CN(C)C=O.CSC1=CC(Cl)=NC(OCC2=CSC=C2)=C1.OC1=CC=CC(C(F)(F)F)=C1.[Cu]I.[H-].[Na+] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CSC1=CC(OCC2=CSC=C2)=NC(OC2=CC=CC(C(F)(F)F)=C2)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC(=O)NC1=NC2=C(S1)C1=NC(C3=CC(Cl)=CC(I)=C3)=NC=C1CC2.CC(=O)NC1=NC2=C(S1)C1=NC(C3=CC(I)=CC=C3F)=NC=C1CC2.CC(=O)NC1=NC2=C(S1)C1=NC(C3=CC=CC(I)=C3)=NC=C1CC2.N=C(N)C1=CC(Cl)=CC(I)=C1.N=C(N)C1=CC(I)=CC=C1F.N=C(N)C1=CC=CC(I)=C1 .",
"input": "",
"output": " CC(=O)NC1=NC2=C(S1)C1=NC(C3=CC(I)=CC=C3Cl)=NC=C1CC2 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. COC1=CC=C(C2CCOCC2)C=C1NC(=S)C1=NC=CN1.O.[C-]#N.[Fe+6].[K+].[OH-] ",
"input": "",
"output": " COC1=CC=C(C2CCOCC2)C2=C1N=C(C1=NC=CN1)S2 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: NC1=CC=C2N=C(NC3CCCCCC3)OCC2=C1.O=C(O)C1CC1 .",
"input": "",
"output": " O=C(NC1=CC=C2N=C(NC3CCCCCC3)OCC2=C1)C1CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC(C)(C)OC(=O)NC1=C(C(=O)O)N=C(C2=CC=CC=C2F)S1.CO[C@@H]1CCN(C2=C(N)C=NN2C)CC[C@H]1NC(=O)OC(C)(C)C is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " COC1CCN(C2=C(NC(=O)C3=C(N)SC(C4=CC=CC=C4F)=N3)C=NN2C)CCC1N ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC(=O)[O-].COC(C)O.O=C(O)CC(=O)O.O=CC1=CC=C(C2=CC=CC=C2)C=C1.[NH4+] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: NC(CC(=O)O)C1=CC=C(C2=CC=CC=C2)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CCOC(=O)C1=C2CN=C(C3=CC=CC=C3F)C3=CC(C#C[Si](C)(C)C)=CC=C3N2C=N1.OCC(F)(F)F.[Br-].[K+] , what product could potentially be produced?",
"input": "",
"output": "The product can be O=C(OCC(F)(F)F)C1=C2CN=C(C3=CC=CC=C3)C3=CC(Br)=CC=C3N2C=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CCN(CC)CC.CCOP(=O)(C#N)OCC.CCS(=O)(=O)N1CCN(C2=CN=C(N)C(C(=O)O)=N2)CC1.CNC1=CC=CC=C1N.COCCOC ",
"input": "",
"output": " CCS(=O)(=O)N1CCN(C2=CN=C(N)C(C3=NC4=CC=CC=C4N3C)=N2)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CN(C)CCN.ClC(Cl)Cl.O.O=C(Cl)N1CCC(OC2=CC=CC(Cl)=C2Cl)C1.O=C([O-])[O-].[K+] ",
"input": "",
"output": " CN(C)CCNC(=O)N1CCC(OC2=CC=CC(Cl)=C2Cl)C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1NC1=C(C(N)=O)C=NN2C=C(Br)C=C12.ClCCl.O=C(O)C(F)(F)F ",
"input": "",
"output": " CC[C@@H]1CNCC[C@H]1NC1=C(C(N)=O)C=NN2C=C(Br)C=C12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CCOC1=CC(C(C)(C)C)=CC=C1C1=N[C@@H](C2=CC=C(F)C=C2)[C@@H](C2=CC=C(F)C=C2)N1C(=O)Cl.CN(C)C(=O)CN1CCNCC1 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CCOC1=CC(C(C)(C)C)=CC=C1C1=N[C@@H](C2=CC=C(F)C=C2)[C@@H](C2=CC=C(F)C=C2)N1C(=O)N1CCN(CC(=O)N(C)C)CC1.Cl ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CC(C)(O)C1=NC2=NC=C(Br)N2C=C1.CCN(C(C)C)C(C)C.CC[Si](CC)(CC)OS(=O)(=O)C(F)(F)F.ClCCl as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CC[Si](CC)(CC)OC(C)(C)C1=NC2=NC=C(Br)N2C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CCN(CC)CC.C[Si](C)(Cl)CC[Si](C)(C)Cl.ClCCl.NCC1=CC=CC(Br)=C1 .",
"input": "",
"output": " C[Si]1(C)CC[Si](C)(C)N1CC1=CC=CC(Br)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(=O)OC(C)=O.CC1=NC(C(O)COC2=CC=C(CC3SC(=O)NC3=O)C=C2)=C(C)O1.CS(C)=O.O Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CC1=NC(C(=O)COC2=CC=C(CC3SC(=O)NC3=O)C=C2)=C(C)O1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.CC(C)(C)OC(=O)N1CCC(N)CC1.CC(C)N=C=O.CCOC(=O)[C@@H]1CN(C(=O)OCC)CC[C@@H]1NS(=O)(=O)C1=CC=C(NC(=O)C2=CC=CC=C2C)C2=CC=CC=C12.[BH4-].[Li+] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CCOC(=O)N1CC[C@H](NS(=O)(=O)C2=CC=C(NC(=O)C3=CC=CC=C3C)C3=CC=CC=C23)[C@H](CO)C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1CCOC1.CC(C)(C)OC(=O)N1CCC(N)CC1.CC(C)N=C=O.CCOC(=O)[C@@H]1CN(C(=O)OCC)CC[C@H]1NS(=O)(=O)C1=CC=C(NC(=O)C2=CC=CC=C2C)C2=CC=CC=C12.[BH4-].[Li+] ",
"input": "",
"output": " CCOC(=O)N1CC[C@@H](NS(=O)(=O)C2=CC=C(NC(=O)C3=CC=CC=C3C)C3=CC=CC=C23)[C@H](CO)C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1CCOC1.CC(C)NC(C)C.COC(=O)C(=CC1=CC=C(F)C=C1)C(=O)C(C)C.COC1=NCCCC1.[LiH] as the reactants and reagents.",
"input": "",
"output": " COC(=O)C(C(=O)C(C)C)C(C1=CC=C(F)C=C1)C1CCCN=C1OC ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C1CCOC1.CC1=CC=CC=C1.CCOC(C)=O.C[C@H](O)C1=CC[C@H]2C3=CC=C4C[C@@H](O[Si](C)(C)C(C)(C)C)C[C@H](O[Si](C)(C)C(C)(C)C)[C@]4(C)[C@H]3CC[C@]12C.C[Si](C)(C)[N-][Si](C)(C)C.O=C(CBr)NCC(F)(F)C(F)(F)F.[Cl-].[K+].[NH4+] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " C[C@H](OCC(=O)NCC(F)(F)C(F)(F)F)C1=CC[C@H]2C3=CC=C4C[C@@H](O)C[C@H](O)[C@]4(C)[C@H]3CC[C@]12C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CS(N)(=O)=O.Cl.ClC[C@@H]1CO1.O.[Na+].[OH-] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: NS(=O)(=O)CC[C@H]1CO1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " Br.CCO.CCOC1=C(N)C(=O)C1=O.NCCN1OC(=O)NC1=O.[Na+].[OH-] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be NC1=C(NCCN2OC(=O)NC2=O)C(=O)C1=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C1CCOC1.CC(C)(Br)C(=O)Br.CCN(CC)CC.ClCCl.O.OCCO as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CC(C)(Br)C(=O)OCCO .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC(C)(C)OC(=O)NCCCC1=NC2=C(OCC3=CC=C(CNC(=O)C(F)(F)F)C=C3)N=C(N)N=C2N1.CN.CO .",
"input": "",
"output": " CC(C)(C)OC(=O)NCCCC1=NC2=C(OCC3=CC=C(CN)C=C3)N=C(N)N=C2N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC1=CC=C(C(=O)O)C=C1I.NC1=CC=CC(C2=CC=CC=N2)=C1.O=C([O-])[O-].O=S(Cl)Cl.[Na+] as the reactants and reagents.",
"input": "",
"output": " CC1=CC=C(C(=O)NC2=CC=CC(C3=CC=CC=N3)=C2)C=C1I ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CCO.CN(C)C1=CC=C(C=O)C=C1.NC1=NC=C(Br)C(N2CCN(CC(=O)NC3=CC=CN=C3)CC2)=C1[N+](=O)[O-].O=S([O-])S(=O)[O-].[Na+] ",
"input": "",
"output": " CN(C)C1=CC=C(C2=NC3=C(N4CCN(CC(=O)NC5=CC=CN=C5)CC4)C(Br)=CN=C3N2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. C1COCCO1.CC1(C)C2=CC=CC(P(C3=CC=CC=C3)C3=CC=CC=C3)=C2OC2=C(P(C3=CC=CC=C3)C3=CC=CC=C3)C=CC=C21.CC1=CN(C2=CC=C(C#N)C(Br)=C2)C2=NC=CC(C3=CN=C4C=CC=CC4=C3)=C12.CCN(C(C)C)C(C)C.CCOC(C)=O.O.O=C(/C=C/C1=CC=CC=C1)/C=C/C1=CC=CC=C1.O[C@H]1CC[C@H](S)CC1.[Pd] ",
"input": "",
"output": " CC1=CN(C2=CC=C(C#N)C(S[C@H]3CC[C@H](O)CC3)=C2)C2=NC=CC(C3=CN=C4C=CC=CC4=C3)=C12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC(C)(C)C1=CC(F)=C2C(=O)N(C3=CC=CC(N4C=C(C#N)C5=CN=CN=C54)=C3CO)N=CC2=C1.CCO.ClCCl.O .",
"input": "",
"output": " CC(C)(C)C1=CC(F)=C2C(=O)N(C3=CC=CC(N4C=C(C(N)=O)C5=CN=CN=C54)=C3CO)N=CC2=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC#N.NO.O=C(C1=CC=C(C2=CC=CC=C2F)C=C1)N1CCC(CC2=NC(C(F)(F)F)=CN2)CC1 as the reactants and reagents.",
"input": "",
"output": " N#CC1=CNC(CC2CCN(C(=O)C3=CC=C(C4=CC=CC=C4F)C=C3)CC2)=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(=O)O.CCOC(C)=O.C[Si](C)(C)OC1(C#N)CCOC2=CC(F)=CC=C21.Cl.O Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " O=C(O)C1CCOC2=CC(F)=CC=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1COCCO1.COC(=O)[C@H](C1=CC=CC=C1)N1CN(C2=CC=CC=C2)C2(CCN(C(=O)OC(C)(C)C)CC2)C1=O.Cl as the reactants and reagents.",
"input": "",
"output": " COC(=O)[C@H](C1=CC=CC=C1)N1CN(C2=CC=CC=C2)C2(CCNCC2)C1=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1COCCO1.COC(=O)[C@@H](C1=CC=CC=C1)N1CN(C2=CC=CC=C2)C2(CCN(C(=O)OC(C)(C)C)CC2)C1=O.Cl Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " COC(=O)[C@@H](C1=CC=CC=C1)N1CN(C2=CC=CC=C2)C2(CCNCC2)C1=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1=CC=C(C2=CNC3=CC=CC=C23)C=C1.CC1=CC=C(S(=O)(=O)N2CCC[C@@H]2C(=O)O)C=C1 as the reactants and reagents.",
"input": "",
"output": " CC1=CC=C(S(=O)(=O)N2CCC[C@@H]2C(=O)N2C=C(C3=CC=CC=C3)C3=CC=CC=C32)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CC#N.CCNC1=NC=CC=C1N.O=C(Cl)C1=CC(Br)=CN=C1Cl.O=C(O)C1=CC(Br)=CN=C1O.O=C([O-])O.O=S(Cl)Cl.[Na+] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CCNC1=NC=CC=C1NC(=O)C1=CC(Br)=CN=C1Cl ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CN1N=C2C=CC=CC2=C1C(=O)O.NC[C@@H]1C[C@@H]2C[C@@H]2N1C(=O)C1=C(C2=CC=CC(F)=C2)SC(N)=N1 as the reactants and reagents.",
"input": "",
"output": " CN1N=C2C=CC=CC2=C1C(=O)NC[C@@H]1C[C@@H]2C[C@@H]2N1C(=O)C1=C(C2=CC=CC(F)=C2)SC(N)=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1CCOC1.CCCCO.C[Si](C)(C)[N-][Si](C)(C)C.O=C1C(Cl)=C(Cl)C=NN1C1=CC=C(F)C(F)=C1.[Na+] ",
"input": "",
"output": " CCCCOC1=C(Cl)C=NN(C2=CC=C(F)C(F)=C2)C1=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C1CCOC1.CC(C)(C)OC(=O)NC1=CC=NC(Cl)=C1.II.[Li]C(C)(C)C as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CC(C)(C)OC(=O)NC1=CC=NC(Cl)=C1I .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. COC1=CC=C(C(=O)C(CC(=O)N[C@H](C(=O)O)C(C)C)SC(C)=O)C=C1F.COC1=CC=C(C(=O)CCC(=O)N[C@H](C(=O)O)C(C)C)C=C1F ",
"input": "",
"output": " COC1=CC=C(C(=O)C(CC(=O)N[C@@H](CC2=CC=CC=C2)C(=O)O)SC(C)=O)C=C1F ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if BrC(Br)(Br)Br.C1=CC=C(P(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.CC#N.C[C@H](CCCO)N(C1=CC(F)=CC=C1F)S(=O)(=O)C1=CC=C(Cl)C=C1.[Cl-].[NH4+] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " C[C@H](CCCBr)N(C1=CC(F)=CC=C1F)S(=O)(=O)C1=CC=C(Cl)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " BrCCCC1=CCC2=CC=CC=C12.CC#N.CC1=CC=NC=C1.CCOCC Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CC1=CC=[N+](CCCC2=CCC3=CC=CC=C23)C=C1.[Br-] ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.CC(C)O.COCCOCCSCCCCCCCCCC1C2=CC=C(OCOC)C=C2SCC1(C)C1=CC=C(OCOC)C=C1.Cl.O Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be COCCOCCSCCCCCCCCCC1C2=CC=C(O)C=C2SCC1(C)C1=CC=C(O)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)(C)C(=O)Cl.CCN(CC)CC.CCOCC.CN(C)N Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CN(C)NC(=O)C(C)(C)C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CCN(CC)S(F)(F)F.CCOC(=O)C1CC(C)(O)C1.ClCCl is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CCOC(=O)C1CC(C)(F)C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C1CCOC1.CC(C)(C)OC(N)=O.CC1=CC(C2=CN=CO2)=NO1.CCB(CC)CC.[Li]CCCC , what product could potentially be produced?",
"input": "",
"output": "The product can be CC[C@H](NC(=O)OC(C)(C)C)C(O)C1=NC=C(C2=NOC(C)=C2)O1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CCN(CC)CC.CCN1C=CC(C(=O)O)=C1.CCN=C=NCCCN(C)C.CCOC(=O)CCN.Cl.ClCCl as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CCOC(=O)CCNC(=O)C1=CN(CC)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CCOC(=O)C1=CC2=CC=C(C)C(C)=C2N1.C[C@H]1CN(C(=O)OC(C)(C)C)S(=O)(=O)O1 , what product could potentially be produced?",
"input": "",
"output": "The product can be CCOC(=O)C1=CC2=CC=C(C)C(C)=C2N1[C@H](C)CNC(=O)OC(C)(C)C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CCO.CCOC(C)=O.CN1CCCC1=O.N#CC1=CN=C(N)C=C1Cl.[H-].[Na+] ",
"input": "",
"output": " CCOC1=CC(N)=NC=C1C#N ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC(C)(C)OC(=O)N1CCC(C(=O)O)CC1.CCN(CC)CC.CCN=C=NCCCN(C)C.CN(C)C=O.Cl.NC1=CC=C(OC2=CC=C(NC(=O)C3=CC=C(Cl)C(Cl)=C3)C=N2)C=C1.O.ON1N=NC2=CC=CC=C21 as the reactants and reagents.",
"input": "",
"output": " CC(C)(C)OC(=O)N1CCC(C(=O)NC2=CC=C(OC3=CC=C(NC(=O)C4=CC=C(Cl)C(Cl)=C4)C=N3)C=C2)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C1=CC=NC=C1.CN(C)C1=CC=NC=C1.NC1=CC=NC=C1.O=S(=O)(Cl)C1=CC=C(Br)S1 .",
"input": "",
"output": " O=S(=O)(NC1=CC=NC=C1)C1=CC=C(Br)S1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C=C(C)OC.CC(=O)OC[C@@H](O)[C@H](CC1=CC=C2OC(F)(F)OC2=C1)C(=O)OC(C)(C)C.CC1(C)C2CCC1(CS(=O)(=O)O)C(=O)C2.CCOC(C)=O.CN(C)C=O.O=C([O-])[O-].[Cl-].[K+].[NH4+] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CC(C)(C)OC(=O)N1[C@@H](CC2=CC=C3OC(F)(F)OC3=C2)[C@@H](CO)OC1(C)C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C1COCCO1.NC1=NC2(CCO1)C1=CC(I)=CC=C1OC1=NC=C(Br)C=C12.O.O=C([O-])[O-].OB(O)C1=CC=CN=C1F.[K+] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: NC1=NC2(CCO1)C1=CC(C3=CC=CN=C3F)=CC=C1OC1=NC=C(Br)C=C12 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC(C)(C)OC(=O)NC1CCC(C(=O)N2CCOCC2)CC1.CO.Cl ",
"input": "",
"output": " NC1CCC(C(=O)N2CCOCC2)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CCCCCCC/C=C/C(=O)O.CCCCN as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CCCCCCC/C=C/C(=O)NCCCC .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CCCNC1=NC(NC2=CC=CC(F)=C2)=NC=C1C#CC1=CC=CC(NC(=O)[C@H](C)NC)=C1.CCN(C(C)C)C(C)C.CCN=C=NCCCN(C)C.CCOC(C)=O.CN(C)C/C=C/C(=O)O.CN(C)C=O.Cl.O=C([O-])O.[Na+] .",
"input": "",
"output": " CCCNC1=NC(NC2=CC=CC(F)=C2)=NC=C1C#CC1=CC=CC(NC(=O)[C@H](C)N(C)C(=O)/C=C/CN(C)C)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC(=O)O.CC(=O)OCC=O.CCCC=O.CNC ",
"input": "",
"output": " CCC(C=O)=CCOC(C)=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.COC(=O)CC1C[C@H]([C@H]2OC(C)(C)N(C(C)=O)[C@H]2CC2=CC(F)=CC(F)=C2)N(C(=O)OC(C)(C)C)C1.[Li+].[OH-] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CC(=O)N1[C@@H](CC2=CC(F)=CC(F)=C2)[C@@H]([C@H]2CC(CC(=O)O)CN2C(=O)OC(C)(C)C)OC1(C)C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC1=NC(C2=CC=CC(C(=O)CC(=O)OC(C)(C)C)=C2)=CO1.CCCN(C)C1=CC(NC(=O)OC(C)(C)C)=C(N)C=C1Cl.ClCCl.O=C(O)C(F)(F)F as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CCCN(C)C1=CC2=C(C=C1Cl)NC(=O)CC(C1=CC=CC(C3=COC(C)=N3)=C1)=N2 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC(C)O.CC1(C)OC2=CC=C(C#N)C=C2[C@@H](N)[C@@H]1O.COC(=O)/C=C(\\CCl)OC.O=C([O-])[O-].[I-].[K+].[Na+] ",
"input": "",
"output": " CO/C(=C/N[C@@H]1C2=CC(C#N)=CC=C2OC(C)(C)[C@H]1O)COC=C=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC(C)(C)OC(=O)N1CCN(C2=CC=C(N)N=C2)CC1.CS(=O)C1=NC=C2C=C(Br)C(=O)N(C3CCCC3)C2=N1 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC(C)(C)OC(=O)N1CCN(C2=CC=C(NC3=NC=C4C=C(Br)C(=O)N(C5CCCC5)C4=N3)N=C2)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC(C)=O.COC1=CC([C@@H]2C3=CC4=C(C=C3[C@H](O)[C@H]3COC(=O)[C@H]23)OCO4)=CC(OC)=C1OC.CS(=O)(=O)O.CSCCC(N)C(=O)O.O ",
"input": "",
"output": " COC1=CC([C@@H]2C3=CC4=C(C=C3[C@@H](O)[C@H]3COC(=O)[C@H]23)OCO4)=CC(OC)=C1O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " COC1=CC=C(NC(=O)C2=CC=C(Cl)N=C2)C(N)=C1.NCCN Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be COC1=CC=C(NC(=O)C2=CC=C(NCCN)N=C2)C(N)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC1=CC=C(C(=O)NC2CC2)C=C1NC(=O)C1=CC(Br)=CS1.OB(OC1=CC=CN=C1)C1=CC=CC=C1 ",
"input": "",
"output": " CC1=CC=C(C(=O)NC2CC2)C=C1NC(=O)C1=CC(C2=CC=CN=C2)=CS1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)(C)[Si](O[C@H]1CC[C@@H](N=[N+]=[N-])[C@]1(C)O)(C1=CC=CC=C1)C1=CC=CC=C1.CCO.[Pd] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CC(C)(C)[Si](O[C@H]1CC[C@@H](N)[C@]1(C)O)(C1=CC=CC=C1)C1=CC=CC=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1COCCO1.CC(=O)OCC(C)(C)[C@@H](OC(C)=O)C(=O)NC[C@H]1O[C@@](O)(CC2=CC=CC=C2)[C@H](NC(=O)C2=CC=C(C3=CC=C(C(=O)N[C@@H]4[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@@H](CNC(=O)[C@H](OC(C)=O)C(C)(C)COC(C)=O)O[C@@]4(O)CC4=CC=CC=C4)C=C3)C=C2)[C@@H](OC(C)=O)[C@@H]1OC(C)=O as the reactants and reagents.",
"input": "",
"output": " CC(C)(CO)[C@@H](O)C(=O)NC[C@H]1O[C@@](O)(CC2=CC=CC=C2)[C@H](NC(=O)C2=CC=C(C3=CC=C(C(=O)N[C@@H]4[C@@H](O)[C@H](O)[C@@H](CNC(=O)[C@H](O)C(C)(C)CO)O[C@@]4(O)CC4=CC=CC=C4)C=C3)C=C2)[C@@H](O)[C@@H]1O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C#CCN(CC)CC.CCCN1C=NC2=C1C(=O)N(CC(C)=O)C(=O)N2C.O=C(O)/C=C/C(=O)O Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CCCN1C=NC2=C1C(=O)N(CC(C)(O)C#CCN(CC)CC)C(=O)N2C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCOC1=CC=C(N2C(=O)C3=CNC4=CC=CC=C4N3C2=O)C=C1.CN(C)C=O.COC(OC)N(C)C Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CCOC1=CC=C(N2C(=O)C3=CN(C)C4=CC=CC=C4N3C2=O)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC(=O)OC(C)=O.CCOCC.O=C(O)CC(CC(=O)O)C1=CC=CC=C1 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: O=C1CC(C2=CC=CC=C2)CC(=O)O1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC1=CC=CC2=NC=C(Cl)N=C12.CCO.[N-]=[N+]=[N-].[Na+] , what product could potentially be produced?",
"input": "",
"output": "The product can be CC1=CC=CC2=C1N1N=NN=C1C=N2 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C1CCNCC1.CC1=C(CCC(=O)N2CCC[C@H]2CN2CCCC2)C(C)=C(C=O)N1.CCO.O=C1CC2=CC(S(=O)(=O)CC3=C(Cl)C=CC=C3Cl)=CC=C2N1 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CC1=C(CCC(=O)N2CCC[C@H]2CN2CCCC2)C(C)=C(/C=C2\\C(=O)NC3=CC=C(S(=O)(=O)CC4=C(Cl)C=CC=C4Cl)C=C23)N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC(C)(C)[O-].CC(C)Br.CCCCCC.CCOC(C)=O.COC(=O)C1=CC=C(OC)C=C1O.CS(C)=O.O.[K+] , what product could potentially be produced?",
"input": "",
"output": "The product can be COC(=O)C1=CC=C(OC)C=C1OC(C)C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.CC[Mg]Cl.COCOC1=CC=C(C2OC3=CC=C(OCOC)C=C3C3CC(=O)CC32)C=C1 Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CCC1(O)CC2C3=CC(OCOC)=CC=C3OC(C3=CC=C(OCOC)C=C3)C2C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC(=O)O[C@@H]1O[C@H](COC(=O)C2=CC=CC=C2)[C@@H](OC(=O)C2=CC=CC=C2)[C@H]1OC(=O)C1=CC=CC=C1.CC1=NC=CC(=O)N1.C[Si](C)(C)N[Si](C)(C)C.C[Si](C)(C)OS(=O)(=O)C(F)(F)F.ClCCCl.O=C([O-])O.O=S(=O)([O-])[O-].[NH4+].[Na+] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CC1=NC(=O)C=CN1[C@@H]1O[C@H](COC(=O)C2=CC=CC=C2)[C@@H](OC(=O)C2=CC=CC=C2)[C@H]1OC(=O)C1=CC=CC=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1CCOC1.CC(=O)CC(=O)C(C)C.N#CC1=CC=C(C=O)C=C1.NC(=O)NC1=CC=CC(C(F)(F)F)=C1 as the reactants and reagents.",
"input": "",
"output": " CC1=C(C(=O)C(C)C)C(C2=CC=C(C#N)C=C2)NC(=O)N1C1=CC=CC(C(F)(F)F)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. C1COCCO1.CC(C)(C)OC(=O)CN.CCN(C(C)C)C(C)C.CCOC(=O)C1=C(O)C2=CC=CN=C2C(C)(C)C1=O.Cl ",
"input": "",
"output": " CC(C)(C)OC(=O)CNC(=O)C1=C(O)C2=CC=CN=C2C(C)(C)C1=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCOC(C)=O.CN(C)C=O.CN1C(=O)C2=C(N=CN2C2=CC=CC=C2Cl)N(C)C1=O.O=C1CCC(=O)N1Cl Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CN1C(=O)C2=C(N=C(Cl)N2C2=CC=CC=C2Cl)N(C)C1=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CCO.Cl.NC1=NC2=CC(Cl)=C(Cl)C=C2NC1=O.NO .",
"input": "",
"output": " O=C1NC2=CC(Cl)=C(Cl)C=C2NC1=NO ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CCOC(C)=O.CI.CN(C)C=O.COC1=NN(C(C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C2=CC(Cl)=NC(NC(=O)OC(C)(C)C)=C12.O=C([O-])[O-].[Cl-].[Cs+].[NH4+] ",
"input": "",
"output": " COC1=NN(C(C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C2=CC(Cl)=NC(N(C)C(=O)OC(C)(C)C)=C12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CCO.Cl.N.O.O=[N+]([O-])CC1OB(O)C2=CC=CC=C21.[Ni] as the reactants and reagents.",
"input": "",
"output": " NCC1OB(O)C2=CC=CC=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC(Br)C1=C(C2=CC=CC(S(=O)(=O)N3CCOCC3)=C2)C2=CC=CC=C2C(=O)O1.CN(C)C=O.NC1=NC=NC2=C1C=NN2.O=C([O-])[O-].[K+] ",
"input": "",
"output": " CC(C1=C(C2=CC=CC(S(=O)(=O)N3CCOCC3)=C2)C2=CC=CC=C2C(=O)O1)N1N=CC2=C(N)N=CN=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C#CCCCN(C)C(=O)OC(C)(C)C.CCNCC.COC1=CC=C(NC(=O)C2=CC=C(N)C(I)=C2)C=C1OC.I[Cu]I is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " COC1=CC=C(NC(=O)C2=CC=C(N)C(C#CCCCN(C)C(=O)OC(C)(C)C)=C2)C=C1OC ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CC=CC=C1.CC(=O)OCC1=CC=C(C)C(C2=CC=CC=[N+]2[O-])=N1.ClP(Cl)Cl.O Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CC(=O)OCC1=CC=C(C)C(C2=CC=CC=N2)=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CC=C(C2CNCCN2)C=C1.O=C1NC2=CC(Cl)=CC=C2NC2=CC=CC=C12 Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be ClC1=CC=C2NC3=CC=CC=C3C(N3CCNC(C4=CC=CC=C4)C3)=NC2=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCO.CCOC(=O)C1=CC(=O)C2=CC=C(OCCCCCOC3=CC=C4C(=O)C=COC4=C3)C=C2O1.O.O=C([O-])O.[Na+] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " O=C(O)C1=CC(=O)C2=CC=C(OCCCCCOC3=CC=C4C(=O)C=COC4=C3)C=C2O1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC(=O)N1CCC(C(=O)C2=CC=C(OC3=CC=CC=C3)C=C2)CC1.Cl ",
"input": "",
"output": " O=C(C1=CC=C(OC2=CC=CC=C2)C=C1)C1CCNCC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.CC(C)N.CSC1=NC(C)=CC(Cl)=N1 Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CSC1=NC(C)=CC(NC(C)C)=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC(=O)O.CCOC(C)=O.O=[N+]([O-])C1=CC=C(OCCN2CCCC2)C(Cl)=C1.[Zn] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " NC1=CC=C(OCCN2CCCC2)C(Cl)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CO[C@@H]1C(=O)N[C@H]1CC1=CC=CC=C1.O=C(NCC1=CC=NC=C1)OC1=CC=CC=C1 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CO[C@@H]1C(=O)N(C(=O)NCC2=CC=NC=C2)[C@H]1CC1=CC=CC=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CN(C)C=O.CS.O=C1C2=C(C=CCN2)CCC2=CC(Cl)=CC=C12.[NaH] , what product could potentially be produced?",
"input": "",
"output": "The product can be CSC1=CC=C2C(=O)C3=C(C=CCN3)CCC2=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCO.NN.O.O=C(C1=CC=CN1)C1=CC=CN=C1Cl Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be C1=CNC(C2=NNC3=NC=CC=C23)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC1(N2CCC(N3C(=O)N[C@H]4CCCC[C@@H]43)CC2)CCNC1.O.O=C(Cl)OCCF.O=C([O-])[O-].[K+] as the reactants and reagents.",
"input": "",
"output": " CC1(N2CCC(N3C(=O)N[C@H]4CCCC[C@@H]43)CC2)CCN(C(=O)OCCF)C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses COC(=O)C1(NC(=O)OC(C)(C)C)CCNCC1.OB(O)C1=CN=C(Cl)N=C1 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: COC(=O)C1(NC(=O)OC(C)(C)C)CCN(C2=NC=C(B(O)O)C=N2)CC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CC(C)N(CCCCOCC(N)=O)C1=CN=C(C2=CC=CC=C2)C(C2=CC=CC=C2)=N1.CC1=CC=CC=N1.ClCCCl.ClCCl.O=S(=O)(O)Cl as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CC(C)N(CCCCOCC(=O)NS(=O)(=O)O)C1=CN=C(C2=CC=CC=C2)C(C2=CC=CC=C2)=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. C1COCCO1.C=C[C@H]1CC[C@H]2[C@@H]3CC(=O)C4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C.COC(C)(C)C.N#CC1=C(C#N)C(=O)C(Cl)=C(Cl)C1=O.O.[NaH] ",
"input": "",
"output": " C=C1CC[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@H]3CC[C@]12C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1CCOC1.CC1=CC=C2C(=C1)N(CC(=O)C1=CC=C(C)O1)C(=O)C(N)CN2C(=O)C(C)(C)C.CCN(CC)CC.CCOC(=O)C1=CC=CC(N)=C1.O.O=C(OC(Cl)(Cl)Cl)OC(Cl)(Cl)Cl ",
"input": "",
"output": " CCOC(=O)C1=CC=CC(NC(=O)NC2CN(C(=O)C(C)(C)C)C3=CC=C(C)C=C3N(CC(=O)C3=CC=C(C)O3)C2=O)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1=CC=C([PH](C2=CC=CC=C2)(C2=CC=CC=C2)[Pd]([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)[PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.CC1=CC=CC=C1.CO.O.O=C([O-])O.OB(O)C1=CC=CC=C1.OC1=C(Br)C=NC2=C(C(F)(F)F)C=CC=C12.OC1=C(C2=CC=CC=C2)C=NC2=C(C(F)(F)F)C=CC=C12.[Na+] as the reactants and reagents.",
"input": "",
"output": " FC(F)(F)C1=CC=CC2=C(C3=CC=CC=C3)C(C3=CC=CC=C3)=CN=C12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C1CCOC1.CC#N.CC1(C)CC(C)(C)CC(O)(C(F)(F)C(=O)N2CCC[C@H]2C2=NOC(COS(C)(=O)=O)=C2)C1.CCOC(C)=O is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CN(C)CC1=CC([C@@H]2CCCN2C(=O)C(F)(F)C2(O)CC(C)(C)CC(C)(C)C2)=NO1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC1=CC=C(S(=O)(=O)O)C=C1.CC1=CC=CC=C1.CCOC(=O)CC1=CN(CC(=O)OCC)C2=CC=CC(N)=C12.O , what product could potentially be produced?",
"input": "",
"output": "The product can be CCOC(=O)CN1C=C2CC(=O)NC3=C2C1=CC=C3 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCOC(=O)[C@@H]1C[C@@H](OS(C)(=O)=O)CN1CC.CN(C)C=O.[N-]=[N+]=[N-].[Na+] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CCOC(=O)[C@@H]1C[C@H](N=[N+]=[N-])CN1CC ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC(=O)CC(=O)C(F)(F)F.NC1=NNC(SCC2=CC=CC=C2)=N1 , what product could potentially be produced?",
"input": "",
"output": "The product can be CC1=NC2=NC(SCC3=CC=CC=C3)=NN2C(C(F)(F)F)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CC(C)(C)OC(=O)NCCOCC1=CC=CC=C1[N+](=O)[O-].CCO.CCOC(C)=O.O.[Cl-].[Fe].[NH4+] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CC(C)(C)OC(=O)NCCOCC1=CC=CC=C1N ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C1CCOC1.CC(C)[N-]C(C)C.CI.COC1=CC(C(F)(F)F)=CC=C1C1=NC(C)(C)CO1.[Li+] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: COC1=C(C2=NC(C)(C)CO2)C=CC(C(F)(F)F)=C1C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CCO.CCOC(=O)COC1=CC=C(SCC=C(C2=CC=CO2)C2=CC=CO2)C=C1C(F)(F)F.[Na+].[OH-] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: O=C(O)COC1=CC=C(SCC=C(C2=CC=CO2)C2=CC=CO2)C=C1C(F)(F)F .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(=O)OC(C)=O.COC1=C(C2=CC=C3N=C(N)SC3=C2)C=C(N2C=CC(=O)NC2=O)C=C1C(C)(C)C Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be COC1=C(C2=CC=C3N=C(NC(C)=O)SC3=C2)C=C(N2C=CC(=O)NC2=O)C=C1C(C)(C)C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CN(C)C=O.NC1=NC=C(Br)N=C1C(=O)NC1=CC=CC=C1.SC1=CC=CC=C1.[H-].[Na+] , what product could potentially be produced?",
"input": "",
"output": "The product can be NC1=NC=C(SC2=CC=CC=C2)N=C1C(=O)NC1=CC=CC=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)[C@H]1NC(=O)[C@@H](CSC(C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)NC(=O)[C@@H](C)NC(=O)C[C@@H](/C=C/CCSC(C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)OC(=O)CNC1=O.CO.ClCCl.O=S([O-])([O-])=S.[Cl-].[Na+] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CC(C)[C@H]1NC(=O)[C@H]2CSSCCC=C[C@H](CC(=O)N[C@H](C)C(=O)N2)OC(=O)CNC1=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " BrC1=CN=CN=C1.C1=CC=C(P(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.C=CC(=O)OC(C)(C)C.CC(=O)[O-].CCN(CC)CC.[Pd+2] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CC(C)(C)OC(=O)C=CC1=CN=CN=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC(C)=O.COC1=CC=C([C@H](N)C(=O)O)C=C1.NC(=O)CCC(=O)NOC(=O)OCC1=CC=CC=C1.O.O=C([O-])O.[Na+] ",
"input": "",
"output": " COC1=CC=C([C@H](NC(=O)OCC2=CC=CC=C2)C(=O)O)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CNC.O=C(O)C1(C2=CC=C(Cl)C(Cl)=C2)CCCCC1 as the reactants and reagents.",
"input": "",
"output": " CN(C)C(=O)C1(C2=CC=C(Cl)C(Cl)=C2)CCCCC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1COCCO1.CN(C)[C@@H]1CCCC[C@H]1N.I[Cu]I.NC(=O)C1=CC=NC=C1.NCCCC1=NC(N2CCN(C3=CC=C(I)C=C3)CC2)=NC2=C1SCC2.O=C([O-])[O-].[K+] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CCCNC1=NC(N2CCN(C3=CC=C(NC(=O)C4=CC=NC=C4)C=C3)CC2)=NC2=C1SCC2 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)[C@H](N)C(=O)O.CC1=CC=C(S(=O)(=O)O)C=C1.CC1=CC=CC=C1.CCOCC.O.O=C(Cl)OC1=CC=CC=C1.OCC1=CC=CC=C1 Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CC(C)[C@H](NC(=O)OC1=CC=CC=C1)C(=O)OCC1=CC=CC=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CC1(C)C(=O)N(C2=CC=C(C#N)C(C(F)(F)F)=C2)C(=O)N1CCCOC1CCCO1.CC1=CC=C(S(=O)(=O)O)C=C1.CCOC(C)=O.CO as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CC1(C)C(=O)N(C2=CC=C(C#N)C(C(F)(F)F)=C2)C(=O)N1CCCO ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C1=CC=C([PH](C2=CC=CC=C2)(C2=CC=CC=C2)[Pd]([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)[PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.COC1=CC=C(B(O)O)C=C1.COCCOC.O.O=C(NCCC1=CNC2=CC=C(Cl)C=C12)C1=CC=CC(I)=C1.O=C([O-])[O-].[Na+] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " COC1=CC=C(C2=CC=CC(C(=O)NCCC3=CNC4=CC=C(Cl)C=C34)=C2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C1=CC=C(N2CCNCC2)N=C1.COC1=CC(C2=C(C(=O)NCCBr)C(=O)C3=CC=CC=C3O2)=CC(OC)=C1OC.ClCCl.O.O=C([O-])[O-].[I-].[K+].[Na+] .",
"input": "",
"output": " COC1=CC(C2=C(C(=O)NCCN3CCN(C4=CC=CC=N4)CC3)C(=O)C3=CC=CC=C3O2)=CC(OC)=C1OC ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CCI.COC1=CC=C(N(CC2=CNN=C2)C(=O)C2CCCC3=C(OCC4=CC=CC=C4)C=CC=C32)C=C1 .",
"input": "",
"output": " CCN1C=C(CN(C(=O)C2CCCC3=C(OCC4=CC=CC=C4)C=CC=C32)C2=CC=C(OC)C=C2)C=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1COCCO1.CC(C)CC(C)O.CC1=CC=C(S(=O)(=O)O)C=C1.O=C(O)CC(O)C(=O)O as the reactants and reagents.",
"input": "",
"output": " CC(C)CC(C)OC(=O)CC(O)C(=O)OC(C)CC(C)C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(=O)O.CCOC(C)=O.NCC1=CC=C(CC2=CC=C(Cl)O2)C=C1.O.O=C([O-])[O-].O=N[O-].[K+].[Na+] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be OCC1=CC=C(CC2=CC=C(Cl)O2)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CC=NC=C1.O.O=C(O)C1=CC(N=C=S)=CC(C(=O)O)=C1.[NaH] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be NC(=S)NC1=CC(C(=O)O)=CC(C(=O)O)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C1CCNCC1.CO.NC1=CC=CC=C1N.O=CC1=CC=CC=C1O is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " NC1=CC=CC=C1N=CC1=CC=CC=C1O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC(C)(C)C1=CC(C(C)(C)C)=C([N+](=O)[O-])C=C1O.CCO.O=C[O-].[NH4+].[Pd] , what product could potentially be produced?",
"input": "",
"output": "The product can be CC(C)(C)C1=CC(C(C)(C)C)=C(O)C=C1N .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)(C)OC(=O)C1=CC=CC=C1C1=CC=C(CBr)C=C1.CCOC1=NC(Br)=C(C=O)N1.CN(C)C=O.O=C([O-])[O-].[K+] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CCOC1=NC(Br)=C(C=O)N1CC1=CC=C(C2=CC=CC=C2C(=O)OC(C)(C)C)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C1=CC=C(P(C2=CC=CC=C2)[C-]2C=CC=C2)C=C1.C1COCCO1.CC(=O)[O-].CC1(C)OB(B2OC(C)(C)C(C)(C)O2)OC1(C)C.ClCCl.Cl[Pd]Cl.FC1=CC=C2C=C(Br)C=CC2=C1.O=C(C1CC1)N1CC[C@@H](CC2=NNC(=O)N2C2=CC=C(Br)C=C2F)C1.O=C([O-])[O-].[Fe+2].[K+] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: O=C(C1CC1)N1CC[C@@H](CC2=NNC(=O)N2C2=CC=C(C3=CC=C4C=C(F)C=CC4=C3)C=C2F)C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. C1=CC=C([PH](C2=CC=CC=C2)(C2=CC=CC=C2)[Pd]([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)[PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.COCCOC.FC1=CC=C2CN(CC3=CC=CC=C3)CCOC2=C1Br.O.O=C([O-])[O-].OB(O)C1=COC=C1.[K+] ",
"input": "",
"output": " FC1=CC=C2CN(CC3=CC=CC=C3)CCOC2=C1C1=COC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC1=CC=CC(O[C@@H]2CCN(C(=O)OCC3=CC=CC=C3)C[C@H]2O)=C1C.CCN(CC)CC.CS(C)=O.ClCCl.O.O=C(Cl)C(=O)Cl .",
"input": "",
"output": " CC1=CC=CC(OC2CCN(C(=O)OCC3=CC=CC=C3)CC2=O)=C1C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC#N.CCN(CC)CC.CN1CCC2=C3C(=CC(F)=C2F)C(=O)C(C(=O)O)=CN31.NCCS ",
"input": "",
"output": " CN1CCC2=C3C(=CC(F)=C2SCCN)C(=O)C(C(=O)O)=CN31 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CN(C)C=O.COC(=O)C1=CNC=N1.C[Si](C)(C)CCOCCl.O=C([O-])[O-].[K+] as the reactants and reagents.",
"input": "",
"output": " COC(=O)C1=CN(COCC[Si](C)(C)C)C=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.CON(C)C(=O)C1=CC=C(Cl)C(Br)=C1.C[Mg]Br Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CC(=O)C1=CC=C(Cl)C(Br)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1CCOC1.COC1=CC=C(CC2=CC(N)=NN2)C=C1.NC1=NNC=C1.O=C1NC2=CC=CC=C2/C1=C/O ",
"input": "",
"output": " COC1=CC=C(CC2=CC(NC=C3C(=O)NC4=CC=CC=C34)=NN2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC#N.CC(=O)NNC(=O)CCC1=CSC(NC2=NC=C(Br)C=C2OCC2=CC=CC=C2)=N1.O=P(Cl)(Cl)Cl as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CC1=NN=C(CCC2=CSC(NC3=NC=C(Br)C=C3OCC3=CC=CC=C3)=N2)O1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses O=C(NC1=CC=CC=C1)N[C@@H]1CCCC[C@H]1NC1CCCNC1.O=[N+]([O-])C1=CC=C(F)C=C1 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: O=C(NC1=CC=CC=C1)N[C@@H]1CCCC[C@H]1N[C@H]1CCCN(C2=CC=C([N+](=O)[O-])C=C2)C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CCC(=O)NN.CCN=C=NCCCN(C)C.Cl.ClCCl.O=C(O)[C@@H]1CC[C@@H]2CN1C(=O)N2OCC1=CC=CC=C1.ON1N=NC2=CC=CC=C21 as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CCC(=O)NNC(=O)[C@@H]1CC[C@@H]2CN1C(=O)N2OCC1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(=O)[O-].CC(Cl)C(=O)C1=C2C=CC=CN2N=C1C(C)C.CCOC(C)=O.CN(C)C=O.O.[K+] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CC(=O)OC(C)C(=O)C1=C2C=CC=CN2N=C1C(C)C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC1=CC=CC(C(=O)C2=CC=C(Cl)C=C2)=C1O.CCO.Cl.NO.O.[K+].[OH-] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC1=CC=CC(C(=NO)C2=CC=C(Cl)C=C2)=C1O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCCCCCCCC1=CC=C(C2CCC(N)(CO)C2)C=C1.O.O=P(O)(O)O.O=P12OP3(=O)OP(=O)(O1)OP(=O)(O2)O3 Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CCCCCCCCC1=CC=C(C2CCC(N)(COP(=O)(O)O)C2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC(=O)N(C)C.CN1CCNCC1.NC(=O)C1=NN(C2=CC=C(F)C=C2)C2=C1CCC1=CC=C(NC(=O)C3=CC=NC(Cl)=C3)C=C12.O ",
"input": "",
"output": " CN1CCN(C2=CC(C(=O)NC3=CC=C4CCC5=C(C4=C3)N(C3=CC=C(F)C=C3)N=C5C(N)=O)=CC=N2)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC(=O)O.NCC(=O)O.O=C1CCCCC1.[H][H].[Pd] ",
"input": "",
"output": " O=C(O)CNC1CCCCC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CO.Cl.N#CC1=CC=C(O)C=C1O.N[C@H](CS)C(=O)O.O.O=C([O-])O.O=P([O-])([O-])[O-].[Na+] ",
"input": "",
"output": " O=C(O)[C@H]1CSC(C2=CC=C(O)C=C2O)=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CO.Cl.N#CC1=CC=C(O)C=C1O.N[C@@H](CS)C(=O)O.O.O=C([O-])O.O=P([O-])([O-])[O-].[Na+] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be O=C(O)C1CSC(C2=CC=C(O)C=C2O)=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with Br.CC(=O)O.COC(=O)C1=CN(CC2=CC=C(F)C=C2)C(=O)C2=C1N1CCN(C)C(=O)C1=C2OCC1=CC=CC=C1.ClCCl as the reactants and reagents.",
"input": "",
"output": " COC(=O)C1=CN(CC2=CC=C(F)C=C2)C(=O)C2=C1N1CCN(C)C(=O)C1=C2O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1=CC=NC=C1.CC1=CC=C(C=NO)C=C1.CCC(=O)OC.CCN(CC)CC.ClC(Cl)Cl.O.O=C1CCC(=O)N1Cl ",
"input": "",
"output": " COC(=O)C1=CC(C2=CC=C(C)C=C2)=NO1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC(C)C1=CC2=C(C=N1)N=C(CN1C=CN=C1C1=NC=CS1)N2.CCI.CN(C)C=O.O.O=C([O-])[O-].[Cs+] .",
"input": "",
"output": " CCN1C(CN2C=CN=C2C2=NC=CS2)=NC2=CC(C(C)C)=NC=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C.CCC(=COCCO)C(=O)OC.CO.[Pd] ",
"input": "",
"output": " CCC(COCCO)C(=O)OC ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC(C)N(CC1=CC=CC=C1)C(=O)CN1C(=O)CC2=NN=C(C3=CC=CC=C3)N2C2=CC(F)=C(F)C=C21.O=CC1=CNC2=CC=C(F)C=C12 ",
"input": "",
"output": " CC(C)N(CC1=CC=CC=C1)C(=O)CN1C(=O)C(=CC2=CNC3=CC=C(F)C=C23)C2=NN=C(C3=CC=CC=C3)N2C2=CC(F)=C(F)C=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC#N.CCCC1=C(C(=O)[O-])N=NN1C1=CC=C(C(=O)NCCN2CCOCC2)C=C1.CCN=C=NCCCN(C)C.CN(C)C=O.NC1CC1.ON1N=NC2=CC=CC=C21.[Na+] , what product could potentially be produced?",
"input": "",
"output": "The product can be CCCC1=C(C(=O)NC2CC2)N=NN1C1=CC=C(C(=O)NCCN2CCOCC2)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC1=CC=CC=C1.CCN(CC)CC.COC(=O)C1=CC=CC=C1S.N#CC1=CC(C2CCCN2C(=O)C2=CC=CC=C2)=CC=N1 ",
"input": "",
"output": " O=C(C1=CC=CC=C1)N1CCCC1C1=CC=NC(C2=NC(=O)C3=CC=CC=C3S2)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. Br.BrBr.CC(=O)O.COC1=C(C)C=CC2=C1CCC2=O.O=C([O-])O.[Na+] ",
"input": "",
"output": " COC1=C(C)C=CC2=C1CC(Br)C2=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C1CCOC1.CC(=O)O[C@@H]1[C@@H](OC(C)=O)[C@H](SC2=CC=C(S(=O)(=O)C3=CC=CC=C3)C=C2)SC[C@H]1OC(C)=O.CCO.CO.C[O-].O.[Na+] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: O=S(=O)(C1=CC=CC=C1)C1=CC=C(S[C@@H]2SC[C@@H](O)[C@H](O)[C@H]2O)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC(C)(C)OC(=O)CBr.CCN(CC)CC.CCOC(C)=O.CN(C)C=O.Cl.O=C(C1=NC2=C(CNCC2)S1)N1CCN(S(=O)(=O)C2=CC=C3C=C(Cl)C=CC3=C2)CC1 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CC(C)(C)OC(=O)CC1CC2=C(CN1)SC(C(=O)N1CCN(S(=O)(=O)C3=CC=C4C=C(Cl)C=CC4=C3)CC1)=N2 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(=O)C1=CC=C(Br)C=C1O.CC(C)(C)OC(=O)N1CCC(=O)CC1.COC(=O)/C=C/C1=CC=C2OC3(CCNCC3)CC(=O)C2=C1 Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CC(C)(C)OC(=O)N1CCC2(CC1)CC(=O)C1=CC=C(Br)C=C1O2 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC1=CC=CC=C1.CO.O=[N+]([O-])C1=CC=C2C(=C1)C(C1=CC=NC(C3CC3)=C1)=NN2C(C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1.[Pd] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " NC1=CC=C2C(=C1)C(C1=CC=NC(C3CC3)=C1)=NN2C(C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1=CC=C(CNCCNCC2=CC=CC=C2)C=C1.CC#N.CCOC(=O)C(Br)C(=O)OCC.[Na+].[OH-] ",
"input": "",
"output": " CCOC(=O)C1C(=O)N(CC2=CC=CC=C2)CCN1CC1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC(=O)O[BH-](OC(C)=O)OC(C)=O.CC1(C)OB(C2=CCC3(CC2)OCCO3)OC1(C)C.O=C(CNC1=NC=NC2=CC=C(C(F)(F)F)C=C12)NC1CNC1.O=C1CCC(C2=CC=CC=C2O)CC1.OC1=CC=CC=C1I.[Na+] ",
"input": "",
"output": " O=C(CNC1=NC=NC2=CC=C(C(F)(F)F)C=C12)NC1CN(C2CCC(C3=CC=CC=C3O)CC2)C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CCC1=CC=CC(CC)=C1C1=CC2=C(C=N1)NC=C2.CCCC(Br)CCC.CCOC(C)=O.CN(C)C=O.O.[H-].[Na+] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CCCC(CCC)N1C=CC2=CC(C3=C(CC)C=CC=C3CC)=NC=C21 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CO.O=CC1CCC2=CC=CC=C2C1=O.O=S(=O)(O)O Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be COC=C1CCC2=CC=CC=C2C1=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CCOC(=O)C1=C(NC2=CC=CC=C2Cl)N2N=CC(S(=O)(=O)NC(C)(C)C)=C2N=C1.FC1=CC=C(C2CCNCC2)C=C1 as the reactants and reagents.",
"input": "",
"output": " CC(C)(C)NS(=O)(=O)C1=C2N=CC(C(=O)N3CCC(C4=CC=C(F)C=C4)CC3)=C(NC3=CC=CC=C3Cl)N2N=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C1=CC=C(P(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.C=CCOC1=CC=C(CS(=O)CCN2C=CN=N2)C=C1.CN1C(=O)CC(=O)N(C)C1=O.ClCCl.[Pd] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " O=S(CCN1C=CN=N1)CC1=CC=C(O)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CC=NC=C1.CC(=O)OC(C)=O.CC(=O)OC1=CC(OC(C)=O)=C2C(C)=C3CCCCN3C(=O)C2=C1.ClC(Cl)Cl Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be C=C1C2=C(C=CC(OC(C)=O)=C2OC(C)=O)C(=O)N2CCCCC12 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C#CCCO.CC1=CC(Cl)=CC=C1NC1=CC=C(C(=O)C2=CC(N=[N+]=[N-])=CC=C2C)C(Cl)=C1 .",
"input": "",
"output": " CC1=CC(Cl)=CC=C1NC1=CC=C(C(=O)C2=CC(N3C=C(CCO)N=N3)=CC=C2C)C(Cl)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC(=O)O.CC1=CC(N)=NN1.COC1=CC=C(C(=O)O)C(CC#N)=C1C , what product could potentially be produced?",
"input": "",
"output": "The product can be COC1=CC=C2C(=O)NC(NC3=NNC(C)=C3)=CC2=C1C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC(C)CN.CC1=CC=CC=C1.CN(C)C=O.O=C(NC1CC1)C1=CC=C(C2=C(CO)N=C3C(Br)=NC(Br)=CN23)C=C1 .",
"input": "",
"output": " CC(C)CNC1=NC(Br)=CN2C(C3=CC=C(C(=O)NC4CC4)C=C3)=C(CO)N=C12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C1CCOC1.CC(C)(C)[Si](C)(C)OCC1=CC=CO1.CCCCCCC.CCOC(C)=O.CN(C)CCN(C)C.ClCCCI.[Li]CCCC , what product could potentially be produced?",
"input": "",
"output": "The product can be CC(C)(C)[Si](C)(C)OCC1=CC=C(CCCCl)O1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC(=O)OC(C)=O.CC(=O)[O-].CC(C=O)CC1=CC=C(C(C)(C)C)C=C1.CCN(CC)CC.O.[Na+] ",
"input": "",
"output": " CC(=O)OC=C(C)CC1=CC=C(C(C)(C)C)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using BBBBBBBBBB.C=O.CC1=CC(O)=CC=C1N.CO.COC(=O)C1=CC=C(C=O)C=C1 as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " COC(=O)C1=CC=C(CN(C)C2=CC=C(O)C=C2C)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C1=CC=NC=C1.CC(=O)[O-].CCCC1=C(CC2=CC=C(C3=CC=CC=C3C#N)C=C2)C(=O)NC(C)=N1.CCN(CC)CC.CCOC(C)=O.ClCCl.OB(O)C1=CC=C2OCCC2=C1.[Cu+2] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CCCC1=C(CC2=CC=C(C3=CC=CC=C3C#N)C=C2)C(=O)N(C2=CC=C3OCCC3=C2)C(C)=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses COC1=CC=C(Br)C=C1[N+](=O)[O-].COC1=CC=C(N2CCOCC2)C2=C1N=C(NC(=O)C1=CC=C(C)S1)S2.O=C(OCC1=CC=CC=C1)N1CCNCC1 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: COC1=CC=C(N2CCN(C(=O)OCC3=CC=CC=C3)CC2)C2=C1N=C(NC(=O)C1=CC=C(C)S1)S2 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C=[N+]=[N-].CC1=C(C(=O)O)N2C(=O)C(NC(=O)C3=CC=CC=C3)[C@H]2S(=O)C1.ClCCl is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " COC(=O)C1=C(C)CS(=O)[C@@H]2C(NC(=O)C3=CC=CC=C3)C(=O)N12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC(C)(C)O.CC(C)(C)[O-].CC(NC(=O)CCl)(C1=CC(Br)=CC=C1F)C(F)(F)CO.[K+] ",
"input": "",
"output": " CC1(C2=CC(Br)=CC=C2F)NC(=O)COCC1(F)F ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCO.CCOC(=O)CCC(=O)C1=CC=C(OCC2=CC(C)=CC=C2C)C=C1.Cl.[Na+].[OH-] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CC1=CC=C(C)C(COC2=CC=C(C(=O)CCC(=O)O)C=C2)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C#CCNC(=O)C1=CC=CN=C1NC1=CC=C(OC)C=C1.CC(C)(C)O.O.O=C1O[C@H]([C@@H](O)CO)C([O-])=C1O.O=S(=O)([O-])[O-].[Cu+2].[N-]=[N+]=NCC1=CC=C(F)C=C1.[Na+] ",
"input": "",
"output": " COC1=CC=C(NC2=NC=CC=C2C(=O)NCC2=CN(CC3=CC=C(F)C=C3)N=N2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C1CCOC1.C=CC1=CC=C(NS(=O)(=O)C2=CC=C(F)C=C2)C(C(=O)O)=C1C.C[N+]1([O-])CCOCC1.O.O=C([O-])O.O=[Os](=O)(=O)=O.[Na+] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC1=C(C(O)CO)C=CC(NS(=O)(=O)C2=CC=C(F)C=C2)=C1C(=O)O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " O=C1C(Cl)=C(OCC2=CC=C(F)C=C2F)C=CN1CC1=CC=C2NC=CC2=C1.[BH3-]C#N.[Na+] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be O=C1C(Cl)=C(OCC2=CC=C(F)C=C2F)C=CN1CC1=CC=C2NCCC2=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC1=NC(C2=CC=C(N)C=C2)=CN1.CCO.CCOC=NC#N is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC1=NC(C2=CC=C(N=CNC#N)C=C2)=CN1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CC=C2NC3=CC=CC=C3OCC2=C1.CCCCCC.COC1=CC=C(CCN2CC[C@H](OS(C)(=O)=O)C2)C=C1.CS(C)=O.[H-].[Na+] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be COC1=CC=C(CCN2CC[C@@H](N3C4=CC=CC=C4COC4=CC=CC=C43)C2)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC(=O)O.CC(=O)OC(C)=O.NC1=NC=CC2=C(C3=CC(C4=CC=CC=C4F)=NC4=NC=CC=C34)N=CC=C12 ",
"input": "",
"output": " CC(=O)NC1=NC=CC2=C(C3=CC(C4=CC=CC=C4F)=NC4=NC=CC=C34)N=CC=C12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CCOCC.COC1=CC=C2C=CC(OC)=C(C(=O)O)C2=C1.N.[Cl-].[LiH].[NH4+] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: COC(=O)C1C(OC)=CCC2=CC=C(OC)C=C21 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: COC(=O)C1=CC=C(NC2=NC=C(F)C(NC3=CC=C(C(=O)OC)C(OC)=C3)=N2)C=C1OC.O=C(O)C1=CC=CC(NC2=NC=C(F)C(NC3=CC=CC(C(=O)O)=C3)=N2)=C1.[Na+].[OH-] , what product could potentially be produced?",
"input": "",
"output": "The product can be COC1=CC(NC2=NC=C(F)C(NC3=CC=C(C(=O)O)C(OC)=C3)=N2)=CC=C1C(=O)O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CC=NC=C1.CCO.CCOC(C)=O.O=C(O)CC(=O)O.O=CC1=CC=C(/C=C/C2=CC=NC=C2)C=C1 Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " O=C(O)C=CC1=CC=C(/C=C/C2=CC=NC=C2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CCNC(=O)NC1=CC=C(C2=NC3=C(CCN(C4=NC=NC(Cl)=N4)C3)C(N3CCOC[C@@H]3C)=N2)C=C1.CO.[Pd] ",
"input": "",
"output": " CCNC(=O)NC1=CC=C(C2=NC3=C(CCN(C4=NC=NC=N4)C3)C(N3CCOC[C@@H]3C)=N2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CN(C)C=O.ClCCCl.ClCCl.N[C@H]1CCCCN(C2=CC=CC=C2)C1=O.O=C(O)[C@H](CC[C@H](CC1=CC=C(F)C=C1)C(=O)O)CC1=CC=C(F)C=C1 .",
"input": "",
"output": " O=C(O)[C@H](CC[C@H](CC1=CC=C(F)C=C1)C(=O)N[C@H]1CCCCN(C2=CC=CC=C2)C1=O)CC1=CC=C(F)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1COCCO1.CN1OC2(CC(C3CCCOC3)OC3=CC=C(Br)C=C32)N=C1N.Cl[Pd](Cl)([PH](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1)[PH](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1.N#CC1=CC=CC(B(O)O)=C1.O=C([O-])[O-].[Cs+] ",
"input": "",
"output": " CN1OC2(CC(C3CCCOC3)OC3=CC=C(C4=CC=CC(C#N)=C4)C=C32)N=C1N ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCCCCO.CS(=O)(=O)CC1=CC=CC(NC2=NC=NC(C3=CC=C(F)C=C3F)=N2)=C1 Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CCCCCOC1=CC(F)=CC=C1C1=NC=NC(NC2=CC=CC(CS(C)(=O)=O)=C2)=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using BrC1=CC=C(N2C(C3=CC=CC=C3)=NC3=CC=CC=C32)C=C1.C1=CC=C([PH](C2=CC=CC=C2)(C2=CC=CC=C2)[Pd]([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)[PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.COCCOC.O=C([O-])[O-].OB(O)C1=CC=C2C(C3=CC=CC=C3)=C3C=CC=CC3=C(C3=CC=CC=C3)C2=C1.[Na+] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " C1=CC=C(C2=C3C=CC(C4=CC=C(N5C(C6=CC=CC=C6)=NC6=CC=CC=C65)C=C4)=CC3=C(C3=CC=CC=C3)C3=CC=CC=C23)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC(=O)OC(C)=O.CCN(CC)CC.COC1=CC=C(NCC(F)(F)F)C=C1Br.ClCCl as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: COC1=CC=C(N(CC(F)(F)F)C(C)=O)C=C1Br .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses Cl.NO.O=CC1=CN(CC2=CC=CC=C2)C2=CC=CC=C12 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: ON=CC1=CN(CC2=CC=CC=C2)C2=CC=CC=C12 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C1=CC=C2C(=C1)NC1=C2SC=C1.CC(C)(C)O[Na].CC(C)(C)P.CC1=CC=CC=C1C.CCCCCCCCOC1=CC=C(Br)C=C1.O=C(/C=C/C1=CC=CC=C1)/C=C/C1=CC=CC=C1.[Pd] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CCCCCCCCOC1=CC=C(N2C3=CC=CC=C3C3=C2C=CS3)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1COCCO1.CC(C)(C)OC(=O)N1CCC(C#CC2=CC(C3=CC=C(C#N)C=C3F)=NC=C2Cl)CC1.CC(C)C1=CC(C(C)C)=C(C2=CC=CC=C2)C(C(C)C)(P(C(C)(C)C)C(C)(C)C)C1.ClC(Cl)Cl.O.O=C(/C=C/C1=CC=CC=C1)/C=C/C1=CC=CC=C1.[K+].[OH-].[Pd] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CC(C)(C)OC(=O)N1CCC(C2=CC3=CC(C4=CC=C(C(N)=O)C=C4F)=NC=C3O2)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC#N.CC(C)CCON=O.CC[C@@H]1C(=O)N(C)C2=CN=C(C3=C(C4=CC=C(F)C=C4)N=C(N)S3)N=C2N1C(C)C.N#C[Cu]C#N is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC[C@@H]1C(=O)N(C)C2=CN=C(C3=C(C4=CC=C(F)C=C4)N=C(C#N)S3)N=C2N1C(C)C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)(C)OC(=O)NCC1=NN(N)C(=O)C2=CC=CC=C12.CC1(C)[C@H]2CC[C@@H](CC(=O)O)[C@@H]1C2 Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CC(C)(C)OC(=O)NCC1=NN(NC(=O)C[C@@H]2CC[C@H]3C[C@@H]2C3(C)C)C(=O)C2=CC=CC=C12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CCOC(C)=O.COC1=CC=C(C2(C=O)CCC(OC)(OC)CC2)C=C1OC1CCCC1.Cl is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " COC1=CC=C(C2(C=O)CCC(=O)CC2)C=C1OC1CCCC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CCOC(=O)C1=C(CBr)NC(C2=NC=CN2C)=NC1C1=CC=C(F)C=C1Br.O=C(O)C1COCCN1 ",
"input": "",
"output": " CCOC(=O)C1=C(CN2CCOCC2C(=O)O)NC(C2=NC=CN2C)=NC1C1=CC=C(F)C=C1Br ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CC(=O)O.CCO.C[C@@H](COC1=CC=NC=C1)NC(=O)OC(C)(C)C.O=[Pt] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " C[C@@H](COC1CCNCC1)NC(=O)OC(C)(C)C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCOC(C)=O.N#CC1=CN=CC(C#CC2=CC=C(F)C(CO)=C2)=C1.O=S(Cl)Cl Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be N#CC1=CN=CC(C#CC2=CC=C(F)C(CCl)=C2)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC(C)(C)OC(=O)NC1CCNC1.CC1=CC=C2N=C(N3CCS(=O)C4=CC=CC=C4C3)N=C(N[C@H]3CN(C(=O)OCC4=CC=CC=C4)C[C@@H]3F)C2=C1.CC1=CC=C2N=C(N3CCS(=O)C4=CC=CC=C4C3)NC(=O)C2=C1 , what product could potentially be produced?",
"input": "",
"output": "The product can be CC1=CC=C2N=C(N3CCS(=O)C4=CC=CC=C4C3)N=C(N3CCC(NC(=O)OC(C)(C)C)C3)C2=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1COCCO1.CCN(C(C)C)C(C)C.CCOC(C)=O.COC1=CC=C(CN)C(OC)=C1.CS(=O)(=O)C1=NC(Cl)=CC(N2C[C@@H](C(=O)NC3CCCCC3)CC[C@H]2C(F)(F)F)=N1 Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be COC1=CC=C(CNC2=NC(Cl)=CC(N3C[C@@H](C(=O)NC4CCCCC4)CC[C@H]3C(F)(F)F)=N2)C(OC)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C=CCC(NC(=O)C1=C(Cl)C=CC=C1Cl)C(=O)OC.COC1=CC=NC(N(C)C2=CC=C(I)C=C2)=N1 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: COC(=O)C(C/C=C/C1=CC=C(N(C)C2=NC=CC(OC)=N2)C=C1)NC(=O)C1=C(Cl)C=CC=C1Cl .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)(C)O.CC1=CC(N)=CC=C1OC1CCN(C(=O)OC(C)(C)C)CC1.COCCOC1=CC2=NC=NC(Cl)=C2C=C1OCCOC.ClCCCl Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " COCCOC1=CC2=NC=NC(NC3=CC=C(OC4CCNCC4)C(C)=C3)=C2C=C1OCCOC.Cl ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C1=CC=NC=C1.CC(C)(C)OC(=O)N1CCC2=C(C=C(CO[Si](C3=CC=CC=C3)(C3=CC=CC=C3)C(C)(C)C)N2C(=O)OC(C)(C)C)C1.CCOC(C)=O.F is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC(C)(C)OC(=O)N1CCC2=C(C=C(CO)N2C(=O)OC(C)(C)C)C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CCN(C(C)C)C(C)C.CN1CCN(C2=CC=C(C(=O)Cl)C=C2)CC1.ClC(Cl)Cl.NC1=NC=CC(C2=CC=CN=C2Cl)=N1 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CN1CCN(C2=CC=C(C(=O)NC3=NC=CC(C4=CC=CN=C4Cl)=N3)C=C2)CC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CC1=CC(NC2CCN(C(=O)OC(C)(C)C)CC2)=C([N+](=O)[O-])C=C1OC(C)C.CCO.NN.O.[Ni] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CC1=CC(NC2CCN(C(=O)OC(C)(C)C)CC2)=C(N)C=C1OC(C)C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1COCCO1.CCN(CC)CC.Cl.NCC1(N)CCOCC1.NS(=O)(=O)C1=CC=C(Cl)C([N+](=O)[O-])=C1.O Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be NC1(CNC2=CC=C(S(N)(=O)=O)C=C2[N+](=O)[O-])CCOCC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CC=NC=C1.CC(=O)[O-].CC(C)C1=CC=CC=C1B(O)O.CCN(CC)CC.COC(=O)C1=CNC2=CC=CC=C12.ClCCl.[Cu+2] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be COC(=O)C1=CN(C2=CC=CC=C2C(C)C)C2=CC=CC=C12 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC#N.C[Si](C)(C)O[C@@H]1C[C@@H](C(=O)O)N(C(=O)OCC2=CC=C([N+](=O)[O-])C=C2)C1.OCCN1CCNCC1 ",
"input": "",
"output": " C[Si](C)(C)O[C@@H]1C[C@@H](C(=O)N2CCN(CCO)CC2)N(C(=O)OCC2=CC=C([N+](=O)[O-])C=C2)C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " COC1=CC(Cl)=C(OC)C=C1N.OC1=CC=CC(NC2=NC(Cl)=NC=C2F)=C1 Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be COC1=CC(NC2=NC=C(F)C(NC3=CC=CC(O)=C3)=N2)=C(OC)C=C1Cl .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) COC(=O)C1=CC(C2=CC=NN2C)=C(C(F)F)C=C1N.CS(=O)(=O)NN.ClCCl.[Na+].[OH-] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CN1N=CC=C1C1=CC2=C(C=C1C(F)F)NC(=O)N(NS(C)(=O)=O)C2=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1CCOC1.C1COCCO1.CC1=CC(C(=O)OC(C)C)=CC(Cl)=N1.CCC([Zn+])CC.[Br-] ",
"input": "",
"output": " CCC(CC)C1=CC(C(=O)OC(C)C)=CC(C)=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C1CCOC1.CC(C)NC(C)C.CCOC(=O)C1=CC=CS1.CN(C)C=O.[Li]CCCC as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CCOC(=O)C1=CC=C(C=O)S1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CCO.ClC(=NN=CC1=CC=CN=C1)C1=CC=CN=C1.S.[K+].[OH-] ",
"input": "",
"output": " C1=CN=CC(C2=NNC(C3=CC=CN=C3)S2)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. BrCC1=CC=C(C2=NC3=CC=CC=C3O2)C=C1.C1CCOC1.CO.OC12CC3CC(C1)C(NC(C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1)C(C3)C2 ",
"input": "",
"output": " C1=CC=C(C(NC2C3CC4CC2CC(OCC2=CC=C(C5=NC6=CC=CC=C6O5)C=C2)(C4)C3)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses COC(=O)C1=CC=NC(C2=CN(CCOS(C)(=O)=O)C=N2)=C1.Cl.ClC1=CC=C2CNCC2=C1 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: O=C(O)C1=CC=NC(C2=CN(CCN3CC4=CC=C(Cl)C=C4C3)C=N2)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CCOC(=O)C(OC(C)(C)C)C1=C(C)C=C2C=CC(Br)=CC2=C1C1=CC=C(Cl)C=C1.CCOC(=O)C(OCC1=CC=C(OC)C=C1)C1=C(C)C(Br)=C2C=CC=CC2=C1O ",
"input": "",
"output": " CCOC(=O)C(OC(C)(C)C)C1=C(C)C(Br)=C2C=CC=CC2=C1C1=CC=C(Cl)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using COC(=O)C1=CC=C(N2CC3(CCNCC3)OC2=O)C=C1.Cl.O=CC1=CC=C(Cl)C(C(F)(F)F)=C1 as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " COC(=O)C1=CC=C(N2CC3(CCN(CC4=CC=C(Cl)C(C(F)(F)F)=C4)CC3)OC2=O)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C1CCOC1.CC(C)(C)N(CC(=O)C1=CC=C(OCC2=CC=CC=C2)C2=C1C=C(C(=O)O)N2)CC1=CC=CC=C1.CC(C)COC(=O)Cl.CCN(CC)CC.CCN1CCOCC1.CN(C)C=O.COC(=O)CN.Cl .",
"input": "",
"output": " COC(=O)CNC(=O)C1=CC2=C(C(=O)CN(CC3=CC=CC=C3)C(C)(C)C)C=CC(OCC3=CC=CC=C3)=C2N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC(C)(C)[O-].CC1=CC=CC=C1.CCOC(=O)[C@H]1CC[C@H](OC(CO)COS(=O)(=O)C2=CC=C(C)C=C2)CC1.[K+].[Na+].[OH-] ",
"input": "",
"output": " O=C(O)[C@H]1CC[C@H](OC2COC2)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C1CCOC1.CCO.CCOC(=O)C1=CC=C(C#CC2=CC=C3SC(C)(C)C=C(C4=CC=C(C)C=C4)C3=C2)N=C1.Cl.[Na+].[OH-] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CCC(C)CCCC1=CC(C)(C)SC2=CC=C(CCC3=CC=C(C(=O)O)C=N3)C=C12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CCC1=NC2=C(C)C=C(C)N=C2N1CC1=CC=C2NC=CC2=C1.CN(C)C=O.N#CC1=CC=CC=C1CBr.[H-].[Na+] , what product could potentially be produced?",
"input": "",
"output": "The product can be CCC1=NC2=C(C)C=C(C)N=C2N1CC1=CC=C2C(=C1)C=CN2CC1=CC=CC=C1C#N .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CCI.COC(=O)[C@H](CC1=CC=C(C2=CC=C(C#N)C=C2)C=C1)NC(=O)[C@@H]1CC2=CC3=C(C=C2CN1S(=O)(=O)C1=C(C)N=C(NC(C)=O)S1)O[C@H](C1=CC=C(OCC2=CC=C(Cl)C(Cl)=C2)C=C1)CO3 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CCN(C(C)=O)C1=NC(C)=C(S(=O)(=O)N2CC3=CC4=C(C=C3C[C@H]2C(=O)N[C@@H](CC2=CC=C(C3=CC=C(C#N)C=C3)C=C2)C(=O)OC)OC[C@@H](C2=CC=C(OCC3=CC=C(Cl)C(Cl)=C3)C=C2)O4)S1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCC1=CC(NC(=S)OC2=CC=CC=C2)=C(OC)N=C1C.COC1=CC=CC=C1N1CCNCC1 Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CCC1=CC(NC(=S)N2CCN(C3=CC=CC=C3OC)CC2)=C(OC)N=C1C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC1=CC=NC=C1C1=CNC(=O)NC1=O.CN(C)C=O.COC(CCBr)OC.Cl.O.O=C([O-])[O-].[K+] ",
"input": "",
"output": " COC(CCN1C=C(C2=CN=CC=C2C)C(=O)NC1=O)OC ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. O=C(Cl)C1=CC=CC(C(=O)OCC2=CC=CC=C2)=C1.O=C1C=C(O)C=CN1 ",
"input": "",
"output": " O=C(OCC1=CC=CC=C1)C1=CC=CC(C(=O)OC2=CC(=O)NC=C2)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C1COCCO1.CC1(C)CC2=CC=CC(O)=C2O1.CCN(CC)CC.CN(SSC1=CC=C(C(C)(C)C)C=C1)C(=O)F.O , what product could potentially be produced?",
"input": "",
"output": "The product can be CN(SSC1=CC=C(C(C)(C)C)C=C1)C(=O)OC1=CC=CC2=C1OC(C)(C)C2 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1CCOC1.CCN(CC)CC.CCOP(=O)(CC#N)OCC.[Br-].[Li+].[N-]=[N+]=NC[C@@H]1CN(C2=CC=C(N3CCC(=O)CC3)C=C2)C(=O)O1 ",
"input": "",
"output": " N#CC=C1CCN(C2=CC=C(N3C[C@@H](CN=[N+]=[N-])OC3=O)C=C2)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CCO.CCOC(=O)NN=C(CO)C1=CC=C(Cl)C=C1.[H-].[Na+] ",
"input": "",
"output": " O=C1NN=C(C2=CC=C(Cl)C=C2)CO1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C=CCBr.C=CCOC1=CC=C(C)C2=C1CCC2.C=CCOCC=C.CC1=CC(C)=CC(C)=C1.CC1=CC=C(O)C2=C1CCC2.O=C([O-])[O-].[K+] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " C=CCC1=CC(C)=C2CCCC2=C1O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CCCCCCCCCCCCCCOC1=CC=C(CC(=O)Cl)C=C1.CCN(CC)CC.CCOC(=O)C1=CC=CC(N)=C1.ClCCl as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CCCCCCCCCCCCCCOC1=CC=C(CC(=O)NC2=CC=CC(C(=O)OCC)=C2)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CCOC(C)=O.O=C(/C=C/C=C/C1=CC=C2OCOC2=C1)NC1CCCCC1.[Pd] as the reactants and reagents.",
"input": "",
"output": " O=C(CCCCC1=CC=C2OCOC2=C1)NC1CCCCC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with COC(OC)N(C)C.COCCCN1CCOC2=CC=C(CO[C@H]3CN(S(=O)(=O)C4=CC=C(C)C=C4)[C@@H](CC(=O)NN)C[C@@H]3C3=CC=C(COC[C@@H](C)COC)C=C3)C=C21.ClCCl as the reactants and reagents.",
"input": "",
"output": " COCCCN1CCOC2=CC=C(CO[C@H]3CN(S(=O)(=O)C4=CC=C(C)C=C4)[C@@H](CC(=O)N/N=C/N(C)C)C[C@@H]3C3=CC=C(COC[C@@H](C)COC)C=C3)C=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C1CCOC1.CCOC(=O)CCCCCCN1CCCC2=NC(C3=CC=C(C)C(F)=C3)=C(C3=CC=C(C)C(F)=C3)N=C21.Cl.O.[Li+].[OH-] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC1=CC=C(C2=NC3=C(N=C2C2=CC=C(C)C(F)=C2)N(CCCCCCC(=O)O)CCC3)C=C1F ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC(C)C1=CC(C(C)C)=C(S(=O)(=O)N2C=C(CCC(=O)O)C3=CC=CC=C32)C(C(C)C)=C1.ClC(Cl)Cl.O=S(Cl)Cl .",
"input": "",
"output": " CC(C)C1=CC(C(C)C)=C(S(=O)(=O)N2C=C3CCC(=O)C4=C3C2=CC=C4)C(C(C)C)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if NC/C=C\\COC1=CC(CN2CCCCC2)=CC=N1.O=C(O)C1=CC=CN1 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " O=C(NC/C=C\\COC1=CC(CN2CCCCC2)=CC=N1)C1=CC=CN1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. COC(=O)CN1CCCC1=O.Cl.NCC12CCCN1CCC2 ",
"input": "",
"output": " O=C(CN1CCCC1=O)NCC12CCCN1CCC2 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CNC1.CCN=C=NCCCN(C)C.Cl.ClCCl.O.O=C(O)CC1=CC=C(O)C=C1F.ON1N=NC2=CC=CC=C21 Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be O=C(CC1=CC=C(O)C=C1F)N1CCC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CC(=O)O.C[C@@H](NC(=O)[C@@H]1C[C@H]2C[C@H]2N1C(=O)CN1N=C(C(N)=O)C2=CC=NC=C21)C1=CC=CC(Cl)=C1F.O=C(OO)C1=CC=CC(Cl)=C1 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: C[C@@H](NC(=O)[C@@H]1C[C@H]2C[C@H]2N1C(=O)CN1N=C(C(N)=O)C2=CC=[N+]([O-])C=C21)C1=CC=CC(Cl)=C1F .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC(C)N(C(=O)CC(C#N)C1=CC=CC=C1)C(C)C.CCO.OO.[Na+].[OH-] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CC(C)N(C(=O)CC(C(N)=O)C1=CC=CC=C1)C(C)C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)(C)OC(=O)NCC(=O)O.CCCCCC.CCOC(C)=O.C[C@@H](N)CC(=O)OCC1=CC=CC=C1 Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be C[C@H](CC(=O)OCC1=CC=CC=C1)NC(=O)CNC(=O)OC(C)(C)C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1CCNCC1.O=CC1=CC2=NC(Cl)=NC(N3CCOCC3)=C2S1 as the reactants and reagents.",
"input": "",
"output": " ClC1=NC(N2CCOCC2)=C2SC(CN3CCCCC3)=CC2=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC(C)(C)OC(=O)N1CCC2(CC1)C(=O)N(CC1=CC=CC=C1)CN2C1=CC=CC=C1.O=C(O)C(F)(F)F as the reactants and reagents.",
"input": "",
"output": " O=C1N(CC2=CC=CC=C2)CN(C2=CC=CC=C2)C12CCNCC2 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CCOC(=O)C1=CC(Br)=CC(C)=N1.OB(O)C1=CN=CC(F)=C1 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CCOC(=O)C1=CC(C2=CN=CC(F)=C2)=CC(C)=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C=CCC1(C)[C@@](C)(C2=CC([N+](=O)[O-])=CC=C2F)N=C(N(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C)C(C)(C)S1(=O)=O.CC(C)=O.CO.ClCCl.O=C([O-])O.O=C=O.O=O.O=[O+][O-].[BH4-].[Na+] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC(C)(C)OC(=O)N(C(=O)OC(C)(C)C)C1=N[C@](C)(C2=CC([N+](=O)[O-])=CC=C2F)C(C)(CCO)S(=O)(=O)C1(C)C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1CCOC1.CC(C)(C)[O-].CCOC(=O)CP(=O)(OCC)OCC.O=CC1=C(Cl)C=CC=C1Cl.[K+] ",
"input": "",
"output": " CCOC(=O)/C=C/C1=C(Cl)C=CC=C1Cl ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1CCOC1.CCCCCC.CN(C)C=O.CN1C2=C(C(=O)NCC2)C2=CC=CC=C21.ClCC1=CN(C(C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=N1.O.[H-].[H][H].[Na+] as the reactants and reagents.",
"input": "",
"output": " CN1C2=C(C(=O)N(CC3=CN(C(C4=CC=CC=C4)(C4=CC=CC=C4)C4=CC=CC=C4)C=N3)CC2)C2=CC=CC=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CN(C)C=O.CNC.ClCCl.N#CCN1C=C(C(=O)O)C2=CC=C(Br)C=C21.OC1=CC=CC2=C1N=NN2 as the reactants and reagents.",
"input": "",
"output": " CN(C)C(=O)C1=CN(CC#N)C2=CC(Br)=CC=C12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CC=C(P(C2=CC=CC=C2)C2=CC=C3C=CC=CC3=C2C2=C3C=CC=CC3=CC=C2P(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.CCOC(=O)C1=CC=CN=C1Cl.NC1=CC(C2=CC=C(F)C=C2)=NN1C1=CC=CC=C1Cl.O=C(/C=C/C1=CC=CC=C1)/C=C/C1=CC=CC=C1.O=C([O-])[O-].[Cs+].[Pd] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CCOC(=O)C1=CC=CN=C1NC1=CC(C2=CC=C(F)C=C2)=NN1C1=CC=CC=C1Cl .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1CCOC1.CCOC1=CC=C(CC2=CC(Br)=CC=C2F)C=C1.CCOCC.COC1=CC=C(COCC(O)(COCC2=CC=C(OC)C=C2)[C@@H](OCC2=CC=CC=C2)[C@H](OCC2=CC=CC=C2)[C@@H](OCC2=CC=CC=C2)C(=O)N(C)OC)C=C1.O=O.[AlH3].[Li]CCCC ",
"input": "",
"output": " CCOC1=CC=C(CC2=CC(C3(O)OC(COCC4=CC=C(OC)C=C4)(COCC4=CC=C(OC)C=C4)[C@@H](OCC4=CC=CC=C4)[C@H](OCC4=CC=CC=C4)C3OCC3=CC=CC=C3)=CC=C2F)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C[Si](C)(C)CCOCN1N=C(C2=CC=CC(NCC3=CC=CS3)=C2)C2=CN=C(NCCN3CCOCC3)N=C21.ClCCl.O=C(O)C(F)(F)F is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " C1=CC(NCC2=CC=CS2)=CC(C2=NNC3=NC(NCCN4CCOCC4)=NC=C23)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if Cl.N.NC(=NO)C1=CN2C=CN=C2C=C1.O=C(Cl)C1=CC=CN=C1 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " C1=CN=CC(C2=NC(C3=CN4C=CN=C4C=C3)=NO2)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: BrBr.CC#N.CC(C)(C)N1COC2=C(C=CC=C2C2=CC=CC=C2)C1.CCO.Cl.O .",
"input": "",
"output": " CC(C)(C)N1COC2=C(C=C(Br)C=C2C2=CC=CC=C2)C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. COC1=CC=CC=C1OC1=C(OCCC(=O)O)N=C(N2CCOCC2)N=C1NS(=O)(=O)C1=CC=C(C(C)(C)C)C=C1.OCC1=CC=CC=C1 ",
"input": "",
"output": " COC1=CC=CC=C1OC1=C(OCCC(=O)OCC2=CC=CC=C2)N=C(N2CCOCC2)N=C1NS(=O)(=O)C1=CC=C(C(C)(C)C)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCOC(=O)Cl.N[C@H]1CC[C@H](NC(=O)C2=CNC3=C(C4=CC=CC=C4OCC4CC4)N=CN=C23)CC1 Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CCOC(=O)N[C@H]1CC[C@H](NC(=O)C2=CNC3=C(C4=CC=CC=C4OCC4CC4)N=CN=C23)CC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC(=O)OC(C)=O.CC(=O)[O-].CC1=COC(N)=C1C#N.CCOC(OCC)OCC.CCOCC.COC1=CC=C(CCN)C=C1.O.[Na+] ",
"input": "",
"output": " COC1=CC=C(CCNC2=NC=NC3=C2C(C)=CO3)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C[Si](C)(C)N=C=O.ClCCl.FC1=CC=C2NC=CC2=C1C1=NC(N2CCOCC2)=C2SC(CN3CC4(CCNCC4)C3)=CC2=N1 Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be NC(=O)N1CCC2(CC1)CN(CC1=CC3=NC(C4=C(F)C=CC5=C4C=CN5)=NC(N4CCOCC4)=C3S1)C2 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. BrC(Br)(Br)Br.C1=CC=C(P(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.CC(O)C1=CC=C(OC(F)(F)F)C=C1.ClCCl ",
"input": "",
"output": " CC(Br)C1=CC=C(OC(F)(F)F)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.CC(C)(C)C1=CC(=O)CC1.CCC[Mg]Br.CCOCC.Cl Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CCCC1=CC(C(C)(C)C)=CC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CCCC(C)OCCCOC(=O)C1=CC(OC(C)=O)=CC=C1C1=CC=CC=C1.CO.[NH4+].[OH-] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CCCC(C)OCCCOC(=O)C1=CC(O)=CC=C1C1=CC=CC=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C=P(C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1.O=C1C2CCN(CC2)C1CC1=CC=CN=C1 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: C=C1C2CCN(CC2)C1CC1=CC=CN=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CCN(C(C)C)C(C)C.C[C@@H]([NH3+])C1=CC=C(OCC(F)(F)F)C=[NH+]1.ClCCCl.ClCCl.O=C(O)CC1=CC=C(C2=CN=CC=N2)C=C1.ON1N=NC2=CC=CN=C21.[Cl-] ",
"input": "",
"output": " C[C@@H](NC(=O)CC1=CC=C(C2=CN=CC=N2)C=C1)C1=CC=C(OCC(F)(F)F)C=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CCC1=C(C)NC(=O)C(C#N)=C1.CCCCCC.ClP(Cl)(Cl)(Cl)Cl.O ",
"input": "",
"output": " CCC1=CC(C#N)=C(Cl)N=C1C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(=O)O.CC1=CC=CC=C1.Cl.NC1=CC(Br)=CC(C(F)(F)F)=C1.O.O=N[O-].O=S=O.[Cl-].[Mg+2].[Na+] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be NS(=O)(=O)C1=CC(Br)=CC(C(F)(F)F)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1CCC2=NCCCN2CC1.C=CCCBr.CC1=CC=CN=C1C(=O)CCC1=COC(C2=CC=C(OC(F)F)C(O)=C2)=N1.CCO.CCOC(C)=O.O ",
"input": "",
"output": " C=CCCOC1=CC(C2=NC(CCC(=O)C3=NC=CC=C3C)=CO2)=CC=C1OC(F)F ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C1=CC=NC=C1.CC(C)[Si](OCC1=CC=C(C(CNC(=O)C2=CC=CC=C2C(=O)O)C(=O)O)C=C1)(C(C)C)C(C)C.CN(C)C1=CC=NC=C1.ClCCCl.NC1=CC=C2C=NC=CC2=C1 .",
"input": "",
"output": " CC(C)[Si](OCC1=CC=C(C(CN2C(=O)C3=CC=CC=C3C2=O)C(=O)NC2=CC=C3C=NC=CC3=C2)C=C1)(C(C)C)C(C)C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CCC1=NC2=C(C)C=C(N(C)C(=NC#N)N(C)C)C=C2N1CC1=CC=C(C2=CC=CC=C2C(=O)OC)C=C1.CCO.[Na+].[OH-] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CCC1=NC2=C(C)C=C(N(C)C(=NC#N)N(C)C)C=C2N1CC1=CC=C(C2=CC=CC=C2C(=O)O)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. COC(=O)NC(C(=O)N1CCCC1C1=NC=C(C2=CC=C(N3CCN(C4=CC=C(C5=CN=C(C6CCCN6C(=O)C(NC(=O)OC)C(C)C)N5COCC[Si](C)(C)C)C=C4)CC3)C=C2)N1COCC[Si](C)(C)C)C(C)C.O=C(O)C(F)(F)F ",
"input": "",
"output": " COC(=O)NC(C(=O)N1CCCC1C1=NC=C(C2=CC=C(N3CCN(C4=CC=C(C5=CN=C(C6CCCN6C(=O)C(NC(=O)OC)C(C)C)N5)C=C4)CC3)C=C2)N1)C(C)C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C=CCN(CC1=CC=C(OC(F)(F)F)C=C1)C1=CC=C(C(C)=O)C=N1.CC#N.CC(=O)[O-].CC1=CC=CC=C1P(C1=CC=CC=C1C)C1=CC=CC=C1C.CCN(C(C)C)C(C)C.COC1=CC=C(Br)C=C1.[Pd+2] ",
"input": "",
"output": " COC1=CC=C(/C=C/CN(CC2=CC=C(OC(F)(F)F)C=C2)C2=CC=C(C(C)=O)C=N2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C=CC1=CN=NC(N2N=C(C)N=C2C)=C1.CC1=CC=CC=C1.CCOC(=O)C=[N+]=[N-] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CCOC(=O)[C@@H]1C[C@H]1C1=CN=NC(N2N=C(C)N=C2C)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)(C)OC(N)=O.CO.O.O=CC1=CC=CC(C(F)(F)F)=C1.O=CO.O=S([O-])C1=CC=CC=C1.[Na+] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CC(C)(C)OC(=O)NC(C1=CC=CC(C(F)(F)F)=C1)S(=O)(=O)C1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C=NC(C)(C)C1=CC=CC(Cl)=C1.CC1=C(CC(C)C)C(=O)OC(C)(C)O1.CC1=CC=CC=C1C Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CC1=C(CC(C)C)C(=O)N(C(C)(C)C2=CC=CC(Cl)=C2)CO1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCOC(C)=O.COC1=CC=C(C(=O)NC2=C(F)C=CC=C2F)C=C1C(=O)CC1=CC=NC(Cl)=N1.ClCCl.NC1=CC(F)=CC=N1.O=C([O-])O.O=C1CCC(=O)N1Br.[Na+] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be COC1=CC=C(C2=C(C3=CC=NC(Cl)=N3)N3C=CC(F)=CC3=N2)C=C1C(=O)NC1=C(F)C=CC=C1F .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC(=O)O.CC(C)C[C@H](NC(=O)[C@H](CC1=CC=CC=C1)NCC(O)[C@H](CC(C)C)NC(=O)OC(C)(C)C)C(=O)OC(C)(C)C.CCOCC.Cl as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CC(C)C[C@H](NC(=O)[C@H](CC1=CC=CC=C1)NCC(O)[C@@H](N)CC(C)C)C(=O)O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1=CC=C([PH](C2=CC=CC=C2)(C2=CC=CC=C2)[Pd]([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)[PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.CCC(O)(/C=C/C1=CC=C(C(CC)(CC)C2=CC(C)=C(B3OC(C)(C)C(C)(C)O3)C(C)=C2)C=C1C)CC.CCOC(=O)CC1=CC=C(Cl)N=C1.CCOC(C)=O.CN(C)C=O.O=P([O-])([O-])[O-].[K+] as the reactants and reagents.",
"input": "",
"output": " CCOC(=O)CC1=CC=C(C2=C(C)C=C(C(CC)(CC)C3=CC=C(/C=C/C(O)(CC)CC)C(C)=C3)C=C2C)N=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CCN(CC)CC.ClCCl.NC1N=C(C2=CC=CC=C2F)C2=CC=CC=C2NC1=O.O=C(Cl)C1=CC2=CC=CC=C2N1 as the reactants and reagents.",
"input": "",
"output": " O=C(NC1N=C(C2=CC=CC=C2F)C2=CC=CC=C2NC1=O)C1=CC2=CC=CC=C2N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CC(C)(C)OC(=O)N1CCCCC1CC(=O)O.N#CC1=CC=CC(C(=O)CBr)=C1 as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CC(C)(C)OC(=O)N1CCCCC1CC(=O)OCC(=O)C1=CC=CC(C#N)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(=O)C1CCCC(C)(C)C1.CC(=O)OC(C)=O.CC(C)(O)C1CCCCC1.CC1(C)CCCC(C(C)(C)O)C1.CCC(=O)OC(=O)CC.C[Mg]Cl Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CCC(=O)OC(C)(C)C1CCCCC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C1CCOC1.CON(C)C(=O)CNC(=O)OC(C)(C)C.C[Mg+].[Br-] .",
"input": "",
"output": " CC(=O)CNC(=O)OC(C)(C)C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C1CCOC1.CO.COCCN(C)CC[C@H](NC(=O)C1=CC2=C(C=NN2CC(C)C)C=C1OC1=CC=C(F)C=C1F)C(=O)OC.[BH4-].[Na+] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: COCCN(C)CC[C@@H](CO)NC(=O)C1=CC2=C(C=NN2CC(C)C)C=C1OC1=CC=C(F)C=C1F .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CC(C)=O.CI.COC(=O)C1=CC=C(CC2=NC3=CC=CC=C3N2)C=C1.O=C([O-])[O-].[K+] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " COC(=O)C1=CC=C(CC2=NC3=CC=CC=C3N2C)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.CC(O)C1=CN=C(Cl)N=C1Cl.CC1(C)CCCC(C)(C)N1O.CCCC[N+](CCCC)(CCCC)CCCC.ClCCl.ClCl.O.O=C([O-])O.[Cl-].[Na+] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CC(=O)C1=CN=C(Cl)N=C1Cl .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CCCCCC.CCOC(C)=O.COC=NC1=C(Cl)C=CC=C1CS(C)(=O)=O.CS(C)=O.[Cl-].[NH4+].[Na+].[OH-] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CS(=O)(=O)C1=CNC2=C(Cl)C=CC=C12 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: Cl.NC1=CC=CC(C2=NC=CC3=C2C=CC(=O)N3)=C1.O.O=N[O-].O=S(=O)(O)O.[NH4+].[Na+].[OH-] , what product could potentially be produced?",
"input": "",
"output": "The product can be O=C1C=CC2=C(C3=CC=CC(O)=C3)N=CC=C2N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: COC(=O)C1=CC=CC(SC2=CC=NC(Cl)=N2)=C1.NC1=CC=C(N2CCOCC2)C=C1 , what product could potentially be produced?",
"input": "",
"output": "The product can be COC(=O)C1=CC=CC(SC2=CC=NC(NC3=CC=C(N4CCOCC4)C=C3)=N2)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.CC#N.NC1=NC=CS1.S=C(N1C=CN=C1)N1C=CN=C1 Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be S=C(NC1=NC=CS1)N1C=CN=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. C1CCOC1.CCOC(C)=O.CN(C)C1=CC=NC=C1.COC1=CC=C(C2(C(=O)Cl)CCCCC2)C=C1.O=C(NOCC1=CC=CC=C1)C1=CC=C(O)C=C1 ",
"input": "",
"output": " COC1=CC=C(C2(C(=O)OC3=CC=C(C(=O)NOCC4=CC=CC=C4)C=C3)CCCCC2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses COC(=O)C(Br)CC1CCCC1.O=C1C(Cl)=C(Cl)C=NN1C1CCCCO1.OC1=CC=CC(OC2=CC=CC=C2)=C1 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: O=C(O)C(CC1CCCC1)N1N=CC(OC2=CC=CC(OC3=CC=CC=C3)=C2)=CC1=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CCC(C)CCCCCBr.CN(C)C=O.OC1=CC=C(O)C(C2=CC=CC=C2COCC2=CC=CC=C2C2=CC(O)=CC=C2O)=C1.[H-].[Na+] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CCC(C)CCCCCOC1=CC=CC=C1OCC1=CC=CC=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C#CC(=O)NC1=CC=C(C2=CC=CC=C2)C=C1.IC1=CC=C(CCN2CCCC2)C=C1.O=C([O-])[O-].[Cs+].[Cu]I as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: O=C(C#CC1=CC=C(CCN2CCCC2)C=C1)NC1=CC=C(C2=CC=CC=C2)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses O=C(O)CC1=CC=CC=C1C(F)(F)F.O=C1NC2=CC=CC=C2C12CCNCC2 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: O=C(CC1=CC=CC=C1C(F)(F)F)N1CCC2(CC1)C(=O)NC1=CC=CC=C12 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CCCC(=N)N.CCOC(=O)CC(=O)C(F)F.CCOC(C)=O.CO.C[O-].Cl.[Na+] as the reactants and reagents.",
"input": "",
"output": " CCCC1=NC(C(F)F)=CC(=O)N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CN1C=CN=C1.CSC1=CC=C(O)C=C1.O=P(Cl)(Cl)Cl .",
"input": "",
"output": " CSC1=CC=C(OP(=O)(Cl)Cl)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CC=C([P+](CC2=CC=CN=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.CCOC(C)=O.CN(C)C=O.O.O=CC1=CN(CC2=CC=C(Cl)C=C2)C2=CC=C(OCC3=CC=C4C=CC=CC4=N3)C=C12.[Cl-].[H-].[Na+] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be ClC1=CC=C(CN2C=C(C=CC3=CC=CN=C3)C3=CC(OCC4=CC=C5C=CC=CC5=N4)=CC=C32)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.CC(C)(C)OC(=O)C1=CC(Cl)=NC(Cl)=C1.CC(C)C[Mg]Cl.CN1CCCC1=O Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CC(C)CC1=CC(C(=O)OC(C)(C)C)=CC(Cl)=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CCCCC1=C(C)C=C(C)C=C1O.CI.CO.O.[K+].[OH-] ",
"input": "",
"output": " CCCCC1=C(C)C=C(C)C=C1OC ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CN(C)[C@@H]1CCC2=CC=CC=C2[C@H](O)C1.CS(C)=O.O=[N+]([O-])C1=CC=CC=C1Cl.[OH-] ",
"input": "",
"output": " CN(C)[C@@H]1CCC2=CC=CC=C2[C@H](OC2=CC=CC=C2[N+](=O)[O-])C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC1=CC=CC=C1.CCN[Si](NCC)(NCC)NCC Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CCN[Si](NCC)(NCC)N(CC)CC .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC(=O)O[C@@H]1[C@@H](OC(C)=O)[C@H](OC(C)=O)CS[C@H]1OC1=CN=CC(Br)=C1.COC1=CC=CC(B(O)O)=C1 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: COC1=CC=CC(C2=CN=CC(O[C@@H]3SC[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]3OC(C)=O)=C2)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CCO.CCOC(=O)C1=CC=C(N)C=C1.CN(C)P(=O)(N(C)C)N(C)C.ClCCCCCCCC1=CC=CC=C1.O.[I-].[Na+] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CCOC(=O)C1=CC=C(NCCCCCCCC2=CC=CC=C2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C1=CC=C(P(C2=CC=CC=C2)[C-]2C=CC=C2)C=C1.C1COCCO1.CCCCN(CCCC)C(=O)C1=CN(COCC[Si](C)(C)C)C(Br)=N1.COC(=O)C1=CC=C(B2OCC(C)(C)CO2)C(C(=O)N2CCC3=CC=CC=C3C2)=C1.Cl[Pd]Cl.O=P([O-])([O-])[O-].[Fe+2].[K+] , what product could potentially be produced?",
"input": "",
"output": "The product can be CCCCN(CCCC)C(=O)C1=CN(COCC[Si](C)(C)C)C(C2=CC=C(C(=O)OC)C=C2C(=O)N2CCC3=CC=CC=C3C2)=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CC(C)(C)OC(=O)N(C1=CC=C2C(=C1)C(I)=NN2C(=O)OC(C)(C)C)S(=O)(=O)C1=CC=CC=C1S(C)(=O)=O.CN(C)C1=CC=CC=C1C1=CC=CC=C1P(C1CCCCC1)C1CCCCC1.COCCOC.ClCCl.NC1=CC=CC=C1.O=C(O)C(F)(F)F.O=C([O-])O.O=C([O-])[O-].[Cs+].[Na+] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CS(=O)(=O)C1=CC=CC=C1S(=O)(=O)NC1=CC=C2NN=C(NC3=CC=CC=C3)C2=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CCO.CCOC=CC(=O)C(=O)O.Cl.NO.O ",
"input": "",
"output": " CCOC(=O)C1=NOC(OCC)C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.CN1C(Cl)=NC(C2=CC=NC=N2)=CC1=O.O=C(CO)C1=CC=CC=C1.[H-].[Na+] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CN1C(OCC(=O)C2=CC=CC=C2)=NC(C2=CC=NC=N2)=CC1=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC1=NC=C(C=NCC2=CN=C(C)N=C2N)C(N)=N1.CC1=NC=C(CO)C(N)=N1 as the reactants and reagents.",
"input": "",
"output": " CC1=NC=C(CNCC2=CN=C(C)N=C2N)C(N)=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: O=[N+]([O-])C1=CC=CC(CBr)=C1.OB(O)C1=COC=C1 .",
"input": "",
"output": " O=[N+]([O-])C1=CC=CC(CC2=COC=C2)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC1=CC(C)=C(S(=O)(=O)[O-])C(C)=C1.CCO.COC(=O)CCl.NN1C=CC=CC1=[NH2+].[Na+].[OH-] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: ClCC1=NN2C=CC=CC2=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. C.C1CCOC1.CCO.CCOC(=O)/C=C/C1=C(C(C)C)N=C(N2C=NC3=CC=CC=C32)S1.[H][H].[Pd] ",
"input": "",
"output": " CCOC(=O)CCC1=C(C(C)C)N=C(N2C=NC3=CC=CC=C32)S1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)[C@H]1CC[C@H](C)C[C@@H]1OC(=O)C1CCCNC1=O.CCO.O=S(=O)(C1=CC=CC=C1)N(F)S(=O)(=O)C1=CC=CC=C1 Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CC(C)[C@H]1CC[C@H](C)C[C@@H]1OC(=O)[C@]1(F)CCCNC1=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CCC1=C(C2=CC=C(Br)C=C2)N(C2=CC=C(Cl)C=C2Cl)N=C1C(=O)NNC(=O)OC(C)(C)C.CO.Cl ",
"input": "",
"output": " CCC1=C(C2=CC=C(Br)C=C2)N(C2=CC=C(Cl)C=C2Cl)N=C1C(=O)NN ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)(C)[Si](C)(C)OCCBr.CCN(C(C)C)C(C)C.COC(=O)/C=C/C1=CC=C(CNCCC2=CNC3=CC=CC=C23)C=C1.CS(C)=O Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be COC(=O)/C=C/C1=CC=C(CN(CCO[Si](C)(C)C(C)(C)C)CCC2=CNC3=CC=CC=C23)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CCO.CCOC(=O)N(O)C1=CC=CC=C1.ClC1=CN=CC=N1.[K+].[OH-] ",
"input": "",
"output": " CCOC(=O)NC1=CC=C(C2=CNC(=O)C=N2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC1=CC=CC=C1.CCCCCC(CO)CO.COC(=O)C1CCC(C=O)CC1 ",
"input": "",
"output": " CCCCCC1COC(C2CCC(C(=O)OC)CC2)OC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: O=CCCCC1=CC=CC=C1.O=S(=O)(C1=CC=C(O)C=C1)C1CNCC1O , what product could potentially be produced?",
"input": "",
"output": "The product can be O=S(=O)(C1=CC=C(O)C=C1)C1CN(CCCCC2=CC=CC=C2)CC1O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C/C=C/[C@@H](C1=CC=C(C(F)(F)F)C=C1)[C@@H](CO)NC(=O)OC(C)(C)C.CO.[Pd] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CCC[C@@H](C1=CC=C(C(F)(F)F)C=C1)[C@@H](CO)NC(=O)OC(C)(C)C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC(=O)OC(C)=O.CC1=CC=CC=C1.CCCCCOC1=CC=CC(N(C)C)=C1.CCN1C(C)=C(C(=O)C2=NC=CC=C2C(=O)O)C2=CC=CC=C21.CO as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CCCCCOC1=CC(N(C)C)=CC=C1C1(C2=C(C)N(CC)C3=CC=CC=C23)OC(=O)C2=CC=CN=C21 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C#CCNC1=C(C)C(C)=NC(Cl)=C1[N+](=O)[O-].CCN(CC)CC.ClCCl.ON=C(Cl)C1=CC=C(F)C=C1 .",
"input": "",
"output": " CC1=NC(Cl)=C([N+](=O)[O-])C(NCC2=CC(C3=CC=C(F)C=C3)=NO2)=C1C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CCN(CC)CC.CN1CCN(C2=CC=CC3=C2C[C@H](N)CC3)CC1.ClCCl.O=C(O)C1=CC=C(C2=CC=C(O)C=C2)C=C1.O=S(Cl)Cl ",
"input": "",
"output": " CN1CCN(C2=CC=CC3=C2C[C@H](NC(=O)C2=CC=C(C4=CC=C(O)C=C4)C=C2)CC3)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: O.O=C(O)CC(CS)C(=O)O .",
"input": "",
"output": " O=C1CC(C(=O)O)CS1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C1=CC=C(P(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.CCOC(=O)N=NC(=O)OCC.CCOC(C)=O.CN(C)C=O.CSC1=CC(C)=NC(SC)=C1NC(=O)CN1CCN(CCO)CC1.Cl.SC1=NC2=CC=C(OCC3=CC=CC=C3)C=C2N1 , what product could potentially be produced?",
"input": "",
"output": "The product can be CSC1=CC(C)=NC(SC)=C1NC(=O)CN1CCN(CCSC2=NC3=CC=C(OCC4=CC=CC=C4)C=C3N2)CC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.CC(=O)O.CC1=NC=C2CC(=O)NC2=N1.CN(C)C=O.ClCCl.[H-].[Na+] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be COC(=O)C1=CN2N=C(C)N=CC2=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. C1CCOC1.CS(=O)C1=NC=CC(C2=CN=C(N)N=C2C(F)(F)F)=N1.C[Si](C)(C)[N-][Si](C)(C)C.NC1=CC=NC=C1.O=C(OCC1=CC=CC=C1)C(F)(F)F.[Li+] ",
"input": "",
"output": " NC1=NC=C(C2=CC=NC(NC3=CC=NC=C3)=N2)C(C(F)(F)F)=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(=O)Cl.CCN(CC)CC.CN1CC[C@@H](OC2=CC=C(O)C=C2)[C@H](C2=CC=CC=C2)C1.ClC(Cl)Cl Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CC(=O)OC1=CC=C(O[C@@H]2CCN(C)C[C@H]2C2=CC=CC=C2)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CCOC(=O)C1=CC(C2=CN=C(C3=CC=CC=C3)S2)=NN1.CCOC(C)=O.ClCCl.O=S(=O)(Cl)Cl ",
"input": "",
"output": " CCOC(=O)C1=C(Cl)C(C2=CN=C(C3=CC=CC=C3)S2)=NN1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CNC=N1.C=CC(C)=O.CC1=CC=CC(O)=C1.CCN.ClC(Cl)Cl Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CC(=O)CCOC1=CC=CC(C)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C=CCN(CCCC)[Si](C)(C)C(C)(C)C.C=C[Si](C)(C)O[Si](C)(C)C=C.CC1=CC=CC=C1.CO[SiH](OC)OC.[Pt] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CCCCN(CCC[Si](OC)(OC)OC)[Si](C)(C)C(C)(C)C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CCOC(=O)[C@@H](N)CS.O=CC1=CC=CC=C1O as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CCOC(=O)[C@@H]1CSC(C2=CC=CC=C2O)N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CC=NC=C1.CC1=CC(C)=C(S(=O)(=O)Cl)C(C)=C1.NC1=CC=C(C[C@H](NC(=O)OCC2C3=CC=CC=C3C3=CC=CC=C32)C(=O)O)C=C1 Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CC1=CC(C)=C(S(=O)(=O)NC2=CC=C(C[C@H](N)C(=O)O)C=C2)C(C)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC1=C(Br)SC(C(C)(C)C(=O)OCC2=CC=CC=C2)=C1.CO.O.[Na+].[OH-] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CC1=C(Br)SC(C(C)(C)C(=O)O)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: COC(=O)[C@@H]1CCC[C@H]1C(=O)NCC#N.COCCOC.Cl.O.[Na+].[OH-] , what product could potentially be produced?",
"input": "",
"output": "The product can be N#CCNC(=O)[C@@H]1CCC[C@H]1C(=O)O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses O=C1NC2=CC(C(F)(F)F)=CC(Br)=C2N1.OB(O)C1=CC=C(C(F)(F)F)C=C1 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: O=C1NC2=CC(C(F)(F)F)=CC(C3=CC=C(C(F)(F)F)C=C3)=C2N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC(C)=O.CCCCC1(N2CCCC2)CCC2(CC1)OCCO2.Cl.O.[Na+].[OH-] .",
"input": "",
"output": " CCCCC1(N2CCCC2)CCC(=O)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC(C)(C)OC(=O)NC1=N[C@@](C2=CC(NC(=O)C3=CC=C(C#N)C=N3)=CC=C2F)(C(F)F)COC1.ClCCl.O=C(O)C(F)(F)F ",
"input": "",
"output": " N#CC1=CC=C(C(=O)NC2=CC=C(F)C([C@]3(C(F)F)COCC(N)=N3)=C2)N=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. BrBr.CO.N#C[S-].NC1=CC(C(F)(F)F)=NN1C1=C(Cl)C=C(C(F)(F)F)C=C1Cl.O=C([O-])[O-].[K+].[Na+] ",
"input": "",
"output": " N#CSC1=C(N)N(C2=C(Cl)C=C(C(F)(F)F)C=C2Cl)N=C1C(F)(F)F ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: O.O=C(O)CCBr.SC1=CC=C(Br)C=C1.[Na+].[OH-] , what product could potentially be produced?",
"input": "",
"output": "The product can be O=C(O)CCSC1=CC=C(Br)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. BrCCCCCCCCCCBr.C1CCOC1.C=CCC(O)C=C.[H-].[H][H].[Na+] ",
"input": "",
"output": " C=CCC(C=C)OCCCCCCCCCCBr ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CCCCN.CCO.Cl.NO.O=C1C2=CC=CC=C2C(=O)N1OCC1=C(F)C(F)=C(F)C(F)=C1F .",
"input": "",
"output": " NOCC1=C(F)C(F)=C(F)C(F)=C1F ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC1=CC=CC=C1.CN1C=CN=C1.FC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)CCI as the reactants and reagents.",
"input": "",
"output": " C[N+]1=CN(CCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)C=C1.[I-] ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C1COCCO1.CC1(C)[C@@H]2CC[C@@]1(C)C(=O)C2C(=O)Cl.CCN(CC)CC.CN(NC1=CC=C(C(F)(F)F)C=C1C(F)(F)F)C(=O)OC(C)(C)C.Cl.ClCCCl.O is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CN1C2=C(C(=O)N1C1=CC=C(C(F)(F)F)C=C1C(F)(F)F)[C@H]1CC[C@]2(C)C1(C)C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1CCOC1.CC1=CN=C(N2CCN(C(=O)C3=CC=C(N4CCCS4(=O)=O)C=C3C(=O)N(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C)CC2)C(C)=C1.CNC ",
"input": "",
"output": " CC1=CN=C(N2CCN(C(=O)C3=CC=C(N4CCCS4(=O)=O)C=C3C(=O)N(C)C)CC2)C(C)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC1(C)CCC(C)(C)C2=CC=CC=C21.ClCCl.O=C(Cl)CCl.[Al+3].[Cl-] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC1(C)CCC(C)(C)C2=CC(C(=O)CCl)=CC=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC1=CC=CC=C1.CCC(=O)O.CCOC(C)=O.NC1=NN(CC2=CC=CC=C2)C(C(F)(F)F)=C1.[BH4-].[Na+].[OH-] ",
"input": "",
"output": " CCCN(CCC)C1=NN(CC2=CC=CC=C2)C(C(F)(F)F)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C=C1CC(=O)O1.CC1=CC=CC=C1.CCCC[N+](CCCC)(CCCC)CCCC.CNC.COS(=O)(=O)OC.Cl.O=N[O-].[Br-].[Na+].[OH-] ",
"input": "",
"output": " CON=C(C(C)=O)C(=O)N(C)C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C.COC(=O)C1=CC=CC(N2CC[C@H](NC(=O)OCC3=CC=CC=C3)[C@H](OC)C2)=C1.[Pd] .",
"input": "",
"output": " COC(=O)C1=CC=CC(N2CC[C@H](N)[C@H](OC)C2)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CCOC(C)=O.CN1C(=O)C(C2=C(Cl)C=CC=C2Cl)=CC2=CN=C(S(C)(=O)=O)N=C21.NC1=CC=C2OCOC2=C1 ",
"input": "",
"output": " CN1C(=O)C(C2=C(Cl)C=CC=C2Cl)=CC2=CN=C(NC3=CC=C4OCOC4=C3)N=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C1CCOC1.CC(C)=CCC/C(C)=C/COC1=CC=C(C(=O)O)C=C1.CC(C)CSC1=NN=C(N)S1.O=C(N1C=CN=C1)N1C=CN=C1.[H-].[Na+] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CC(C)=CCC/C(C)=C/COC1=CC=C(C(=O)NC2=NN=C(SCC(C)C)S2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C1=CC=C2C(=C1)CC1=CC=CC=C12.C=CCCl.CC(C)(C)[O-].CCCCCC.CN(C)C=O.O.[Cl-].[K+] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " C=CCC1(CC=C)C2=CC=CC=C2C2=CC=CC=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " COC1=CC=C(C2CC(C(F)(F)F)N3N=C(C4=CC=CC(C(=O)O)=C4)C=C3N2)C=C1OC.C[C@@H]1CNC[C@H](NC(=O)OC(C)(C)C)C1 Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be COC1=CC=C(C2CC(C(F)(F)F)N3N=C(C4=CC=CC(C(=O)N5C[C@@H](C)C[C@@H](NC(=O)OC(C)(C)C)C5)=C4)C=C3N2)C=C1OC .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. C1CSCCN1.CC1=CC=CC=C1.ClCCl.NC1=CNN=C1C1=NC2=CC(CN3CCOCC3)=CC=C2N1.O=C(Cl)Cl ",
"input": "",
"output": " O=C(NC1=CNN=C1C1=NC2=CC(CN3CCOCC3)=CC=C2N1)N1CCSCC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C(=NC1CCCCC1)=NC1CCCCC1.C=CCOC(=O)N1C[C@H](O[Si](C)(C)C(C)(C)C)C[C@H]1C(=O)O.CC1(C)OC(=O)CC(=O)O1.CCOC(C)=O.CN(C)C1=CC=NC=C1.ClCCl ",
"input": "",
"output": " C=CCOC(=O)N1C[C@H](O[Si](C)(C)C(C)(C)C)C[C@H]1C(C)=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: COC1=NC(C=CC2=CC=CC(OC)=C2)CCCC1.[Cl-].[NH4+] , what product could potentially be produced?",
"input": "",
"output": "The product can be COC1=CC=CC(C=CC2CCCCC(=N)N2)=C1.Cl .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C1CCOC1.COC(C)(C)C.NN.O.[Na+].[OH-] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CC1(OC(=O)NN)CCCCC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC1(C)CC(=O)C2=CC=C(OS(=O)(=O)C(F)(F)F)C=C21.OB(O)C1=CC=C(Cl)C=C1Cl is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC1(C)CC(=O)C2=CC=C(C3=CC=C(Cl)C=C3Cl)C=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC(C)=O.COC1=CC(F)=CC=C1O.O.O=C(CBr)C1=CC=C(Br)C=C1.O=C([O-])[O-].[Cs+] .",
"input": "",
"output": " COC1=CC(F)=CC=C1OCC(=O)C1=CC=C(Br)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC1=CC=C(S(=O)(=O)N2C=C(C3=CN(CC4=CC=CC(C)=C4)N=C3)C3=CC(C4=CC=C(N5CCNCC5)N=C4)=CN=C32)C=C1.CCN(C(C)C)C(C)C.CCO.C[C@H]1CO1.Cl Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CC1=CC=C(S(=O)(=O)N2C=C(C3=CN(CC4=CC=CC(C)=C4)N=C3)C3=CC(C4=CC=C(N5CCN(C[C@H](C)O)CC5)N=C4)=CN=C32)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CCCCCCC[Si]1(C2=CC=CC=C2)CCC(CBr)CC1.OC1=CC=C(OCC(F)(F)F)C(F)=C1 ",
"input": "",
"output": " CCCCCCC[Si@H]1CC[C@H](COC2=CC=C(OCC(F)(F)F)C(F)=C2)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C1=CC=[NH+]C=C1.C1=COCCC1.CCCCCCCCCCCC1CC(O)C(CCCCCC)C(=O)O1.COC(C)(C)C.[Na+].[OH-] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CCCCCCC(C(=O)O)C(O)CC(CCCCC)OCC1=CC=CC=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CC2=CC(C3CO3)=CC=C2O1.CC(C)(C)[O-].CCOC(C)=O.CS(C)=O.Cl.OCC1=CC=CN=C1.[K+] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be OC(COCC1=CC=CN=C1)C1=CC=C2OC=CC2=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CO.NO.O=C(CCC(F)(F)C(F)(F)F)C1=CC=CC=N1.O=C(O)C(F)(F)F.[Na+].[OH-].[Zn] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " NC(CCC(F)(F)C(F)(F)F)C1=CC=CC=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CCOC(=O)Cl.CN(C)C=O.COCOC1=CC=C(C(CNS(=O)(=O)C2=CC=C(Cl)C=C2)CC2=CC=CN=C2)C=C1.O.[H-].[Na+] ",
"input": "",
"output": " CCOC(=O)N(CC(CC1=CC=CN=C1)C1=CC=C(OCOC)C=C1)S(=O)(=O)C1=CC=C(Cl)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC(C)(C)OC(=O)N1CCC(C2=CC=CC=C2CO)CC1.CCOCC.Cl.ClCCl , what product could potentially be produced?",
"input": "",
"output": "The product can be OCC1=CC=CC=C1C1CCNCC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with BrB(Br)Br.COC(=O)C1=CC(S(=O)(=O)N(CC(C)C)C2=CC=C(C)C=C2C)=CC=C1OC.ClCCl.O as the reactants and reagents.",
"input": "",
"output": " COC(=O)C1=CC(S(=O)(=O)N(CC(C)C)C2=CC=C(C)C=C2C)=CC=C1O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C(=NC1CCCCC1)=NC1CCCCC1.CC(C)C[C@H](NC(=O)OC(C)(C)C)C(=O)O.CCCC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)OCC1=CC=CC=C1)[C@@H](C)O.CN(C)C=O.O=C(O)C(F)(F)F.O=C1C2C3C=CC(C3)C2C(=O)N1O as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)OCC1=CC=CC=C1)[C@@H](C)O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CN1CCC(O)CC1.NC1=NON=C1C1=NC2=CN=CC=C2N1C1=CC=CC(O)=C1 Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CN1CCC(OC2=CC=CC(N3C(C4=NON=C4N)=NC4=CN=CC=C43)=C2)CC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses COC1=CC=C2CN(C3=CC(Cl)=C4C=C(Cl)C=CC4=N3)CCS(=O)(=O)C2=C1.NCC1(CN)COC1 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: COC1=CC=C2CN(C3=CC(NCC4(CN)COC4)=C4C=C(Cl)C=CC4=N3)CCS(=O)(=O)C2=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CCN(CC)CC.Cl.ClCCl.O=C1N=CC(Cl)=CN1.O=CN(CCl)C1=CC=CC=C1 as the reactants and reagents.",
"input": "",
"output": " O=CN(CN1C=C(Cl)C=NC1=O)C1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C1CNC1.CC#N.CC1=CC=C(S(=O)(=O)OCC2CCC3=CC=C(S(C)(=O)=O)C=C3O2)C=C1 .",
"input": "",
"output": " CS(=O)(=O)C1=CC=C2CCC(CN3CCC3)OC2=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.C=C[Mg]Br.O=[N+]([O-])C1=CC=C(Cl)C2=NC=CC=C12.[Cl-].[NH4+] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " ClC1=CC2=C(NC=C2)C2=CC=CN=C12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1CCOC1.CC1(C)CC2=NC(C3CCCC3)=C(C(=O)C3=CC=C(C(F)(F)F)C=C3)C(C3CCCCC3)=C2[C@@H](O[Si](C)(C)C(C)(C)C)C1.O=C([O-])C(O)C(O)C(=O)[O-].[Al+3].[H-].[K+].[Li+].[Na+] ",
"input": "",
"output": " CC1(C)CC2=NC(C3CCCC3)=C([C@@H](O)C3=CC=C(C(F)(F)F)C=C3)C(C3CCCCC3)=C2[C@@H](O[Si](C)(C)C(C)(C)C)C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC(C)(C)OC(=O)N1CCC(CN2C=NC=N2)(C2CCCCC2)CC1.ClCCl.O.O=C(O)C(F)(F)F , what product could potentially be produced?",
"input": "",
"output": "The product can be C1=NN(CC2(C3CCCCC3)CCNCC2)C=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C1=CC=C(P(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.C1=CC=C([PH](C2=CC=CC=C2)(C2=CC=CC=C2)[Pd]([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)[PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.C1=CC=CC=C1.C=O.CN(C)C=O.CN1CC2=C(Cl)C=C(Cl)C=C2C(C2=CC=C(Br)C=C2)C1.Cl[Pd]Cl , what product could potentially be produced?",
"input": "",
"output": "The product can be CN1CC2=C(Cl)C=C(Cl)C=C2C(C2=CC=C(C(=O)O)C=C2)C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC1=CC=C(S(=O)(=O)N=[N+]=[N-])C=C1.CCCCCC1CCC(S(=O)(=O)CS(=O)(=O)C2CCC(CCCCC)CC2)CC1.CCO.CN(C)C=O.O.[Na+].[OH-] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CCCCCC1CCC(S(=O)(=O)C(=[N+]=[N-])S(=O)(=O)C2CCC(CCCCC)CC2)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C=C(Cl)CC1(C)CC2=CC(O)=C(Cl)C(Cl)=C2C1=O.CCOC(=O)CBr.CN(C)C=O.O=C([O-])[O-].[K+] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be C=C(Cl)CC1(C)CC2=CC(OCC(=O)O)=C(Cl)C(Cl)=C2C1=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCCCCCCCCCCCCCCCNC1=CC=C(C#CC(N)=O)C=C1.Cl.O=S(Cl)Cl Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CCCCCCCCCCCCCCCCNC1=CC=C(C#CC#N)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C1CCOC1.CO.COC(=O)CCC1=CC=C(N(C(=O)OC(C)(C)C)C2=CC=CC=C2)C=C1.O.[Na+].[OH-] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CC(C)(C)OC(=O)N(C1=CC=CC=C1)C1=CC=C(CCC(=O)O)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CC#N.CC(C)(C)ON=O.COC(=O)C1=C(I)SC(N)=N1.Cl[Cu].[Cl-].[NH4+] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: COC(=O)C1=C(I)SC(Cl)=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC1=NC(C(=O)N2CCN(C)CC2CC2=CC3=CC(Cl)=CC=C3O2)=C(C2=CC=C(F)C=C2)S1.O=C1C(S(=O)(=O)[O-])=CC2=CC(S(=O)(=O)[O-])=CC=C2/C1=N/NC1=CC=C(S(=O)(=O)[O-])C2=CC=CC=C12.[Na+] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CC1=NC(C(=O)N2CCNCC2CC2=CC3=CC(Cl)=CC=C3O2)=C(C2=CC=C(F)C=C2)S1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1CCOC1.CC(C)(C)[O-].C[C@]12CC[C@@H]3C4=CC=C(O)C=C4CC[C@H]3[C@@H]1CCC2=O.C[P+](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1.O.[Br-].[K+] ",
"input": "",
"output": " C=C1CCC2C3CCC4=CC(O)=CC=C4C3CCC12C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC(C)=O.CC1=C(CCO)N=C(C2=CC=CC=C2)O1.O.O=S(=O)(O)O.[Cr+6].[O-2] ",
"input": "",
"output": " CC1=C(CC(=O)O)N=C(C2=CC=CC=C2)O1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if BrBr.CC(C)C1=CC(C(C)C)=C(CCl)C(C(C)C)=C1.ClC(Cl)(Cl)Cl.[Fe] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC(C)C1=CC(C(C)C)=C(CCl)C(C(C)C)=C1Br ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC#N.CCCCOC1=CC(C(N)CC(=O)OC)=CC=C1OC.CCOC(=O)N1C(=O)C2=CC=CC=C2C1=O.Cl.O.O=C([O-])[O-].[Na+] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CCCCOC1=CC(C(CC(=O)OC)N2C(=O)C3=CC=CC=C3C2=O)=CC=C1OC ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. C1=CNC=N1.C1CCOC1.CC(C)(C)[Si](C)(C)Cl.CN(C)C=O.COC(=O)C1=CC=NC(NC2=NC=CS2)=C1.ClCCl.O.[Al+3].[H-].[Li+].[Na+].[OH-] ",
"input": "",
"output": " CC(C)(C)[Si](C)(C)OCC1=CC=NC(NC2=NC=CS2)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC(C)C[C@H](NC(=O)OC(C)(C)C)C(=O)O.ClCCCl.ClCCl.N#CC(C(=O)C(N)CC(F)F)=P(C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1.ON1N=NC2=CC=CC=C21 , what product could potentially be produced?",
"input": "",
"output": "The product can be N#CC(C(=O)CCC(F)F)=P(C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1CCOC1.COC(=O)C1=CC=C(Cl)C2=C1N1CCCN(C3=C(C)C=C(Cl)C=C3Cl)C1=N2.[BH4-].[Li+] ",
"input": "",
"output": " CC1=CC(Cl)=CC(Cl)=C1N1CCCN2C1=NC1=C(Cl)C=CC(CO)=C12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1CCC2=NCCCN2CC1.C1CCOC1.O=S(=O)(OC1=CC=C2C(=C1)CCCC2O)C(F)(F)F.[N-]=[N+]=NP(=O)(C1=CC=CC=C1)C1=CC=CC=C1 ",
"input": "",
"output": " [N-]=[N+]=NC1CCCC2=CC(OS(=O)(=O)C(F)(F)F)=CC=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: BrC1=CC=C2N=CNC2=C1.C1CCOC1.CN(C)C1=CC=CC=C1C1=CC=CC=C1P(C1CCCCC1)C1CCCCC1.COC1=CC=C(CN)C=C1OC.C[Si](C)(C)[N-][Si](C)(C)C.O=C(/C=C/C1=CC=CC=C1)/C=C/C1=CC=CC=C1.[Li+].[Pd] , what product could potentially be produced?",
"input": "",
"output": "The product can be COC1=CC=C(CNC2=CC=C3N=CNC3=C2)C=C1OC .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using BrB(Br)Br.CC(C)(C)OC(=O)OC(=O)OC(C)(C)C.CCOC(C)=O.COC1=CC=CC2=C1C(=O)N1CCN(C(=O)OC(C)(C)C)CC21.ClCCl as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CC(C)(C)OC(=O)N1CCN2C(=O)C3=C(O)C=CC=C3C2C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C#CC[C@@H](NC(=O)OC(C)(C)C)C(=O)[O-].C1CCOC1.O.O=C([O-])O.[Al+3].[H-].[Li+].[Na+] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be C#CC[C@H](CO)NC(=O)OC(C)(C)C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC(C)(C)OC(=O)N1CCC(C(=O)O)CC1.CN(C)C=O.N/C(CC1=CC=CN=C1)=N\\O.O=C(N1C=CN=C1)N1C=CN=C1 , what product could potentially be produced?",
"input": "",
"output": "The product can be CC(C)(C)OC(=O)N1CCC(C2=NC(CC3=CC=CN=C3)=NO2)CC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CO.CS(=O)(=O)[O-].ClCCl.O.O=P12OP3(=O)OP(=O)(O1)OP(=O)(O2)O3.O=S(=O)([O-])C(F)(F)F.O=S(C1=CC=C(F)C=C1)C1=CC=C(F)C=C1.OC1=CC=C(C2(C3=CC=C(O)C=C3)C3=CC=CC=C3C3=CC=CC=C32)C=C1.[Li+] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: OC1=CC=C(C2(C3=CC=C(O)C=C3)C3=CC=CC=C3C3=CC=C([S+](C4=CC=C(F)C=C4)C4=CC=C(F)C=C4)C=C32)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC(C)=O.CCO.O.O=CC1=CC=C(Cl)C=C1.[Na+].[OH-] ",
"input": "",
"output": " CC(=O)C=CC1=CC=C(Cl)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC1=CC(NC2=NC(C(=O)C3=CC=C(F)C=C3)=NC3=CC(Br)=CC=C23)=NN1.CC1=CC(NC2=NC(C(=O)C3=CC=C(F)C=C3)=NC3=CC=C(F)C=C23)=NN1 .",
"input": "",
"output": " CC1=CC(NC2=NC(C(O)C3=CC=C(F)C=C3)=NC3=CC(Br)=CC=C23)=NN1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC(=O)OCC1=C(C(=O)O)N2C(=O)[C@@H](N)[C@H]2SC1.CO.ClC(Cl)(Cl)Cl.Cl[Bi](Cl)Cl ",
"input": "",
"output": " COCC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC1=CC=C(C2=CN(C)N=C2)C(C(=O)N2CCC[C@@H](C)[C@H]2CN)=C1.CC1=NC(C(=O)O)=C(C2=CC=CC(F)=C2)S1 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC1=NC(C(=O)N2CCC[C@@H](C)[C@H]2CN)=C(C2=CC=CC(F)=C2)S1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC(C)(C)OC(=O)NC1(C2=CC=C(C3=C(C4=CC=CC=C4)OC4=CC=C(C#N)C=C4C3=O)C=C2)CCC1.COC1=CC=C2C(=O)C(C3=CC=C(C4(NC(=O)OC(C)(C)C)CCC4)C=C3)=C(C3=CC=CC=C3)OC2=C1Br ",
"input": "",
"output": " COC1=CC=C2C(=O)C(C3=CC=C(C4(NC(=O)OC(C)(C)C)CCC4)C=C3)=C(C3=CC=CC=C3)OC2=C1C#N ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC1=NOC(C)=C1B(O)O.COC(=O)C1=CC=CC(COC2=CC=C(I)C=C2)=C1 ",
"input": "",
"output": " CC1=NOC(C)=C1C1=CC=C(OCC2=CC=CC(C(=O)O)=C2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC(=O)O.CC(C)=O.CCOC(=O)C1=NC2=CC=CC=C2N=C1Cl.CNC(=S)NC as the reactants and reagents.",
"input": "",
"output": " CCOC(=O)C1=NC2=CC=CC=C2N=C1SC(NC)NC.Cl ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC(C)(C#N)N=NC(C)(C)C#N.COC(=O)C(OC1=CC=CC=C1)C1=CC=C(C)C=C1.ClC(Cl)(Cl)Cl.O=C1CCC(=O)N1Br is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " COC(=O)C(OC1=CC=CC=C1)C1=CC=C(CBr)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CS(C)=O.ClCCCOC1=CC=C2C=CC=CC2=C1.NCC1=CC=CC=C1.O.O=C([O-])[O-].[K+] , what product could potentially be produced?",
"input": "",
"output": "The product can be C1=CC=C(CNCCCOC2=CC=C3C=CC=CC3=C2)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C1CCOC1.CCN(CC)CC.CCOC(=O)Cl.CNC.ClCCl.O=C(O)CC(CSCCNC(=O)CC1CCCCC1)C(=O)C1=CC=CN=C1 as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CN(C)C(=O)CC(CSCCNC(=O)CC1CCCCC1)C(=O)C1=CC=CN=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CN(C)CCO.COC1=CC=CC=C1C(O)C1=CC=C(NC(=O)C2(C3=CC=C4OCOC4=C3)CC2)N=C1.COC1=CC=CC=C1C(OCCCO)C1=CC=C(NC(=O)C2(C3=CC=C4OCOC4=C3)CC2)N=C1 Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be COC1=CC=CC=C1C(OCCN(C)C)C1=CC=C(NC(=O)C2(C3=CC=C4OCOC4=C3)CC2)N=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(=O)C1=CN=C2C([N+](=O)[O-])=CC=CC2=C1Cl.CNN.ClCCCl Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CC1=C2C=NC3=C([N+](=O)[O-])C=CC=C3C2=NN1C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CCCC[Sn](CCCC)(CCCC)C1=NC=CS1.N#CC1=CC=CN=C1Cl .",
"input": "",
"output": " N#CC1=CC=CN=C1C1=NC=CS1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC(=O)Cl.CCOC(=O)C(C)C(=O)CC(=O)OC.CO.NCC1=CC=CC=C1 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CCOC(=O)C(C)C(NCC1=CC=CC=C1)=C(C(C)=O)C(=O)OC .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C1=CC=CC=C1.COC1=CC([C@H]2[C@@H](C(=O)O)C3=CC=CC=C3C(=O)N2C)=CC(OC)=C1OC.O=S(Cl)Cl is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " COC1=CC2=C(C(=O)C3=C2N(C)C(=O)C2=CC=CC=C32)C(OC)=C1OC ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using BrCC1=CC=CC=C1.C1CCOC1.CN1CCCN(C)C1=O.Cl.[Li]CCCC as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " NCC#CCC1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC1=CC(F)=NC=C1C(=O)O.OCC(F)F as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CC1=CC(OCC(F)F)=NC=C1C(=O)O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC1(C)COC(CC(CCO)SC2=CC3=CC=CC=C3N2)=N1.CCN(CC)CC.CS(=O)(=O)Cl.ClCCl.O Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CC1(C)COC(CC2CCC3=C(NC4=CC=CC=C34)S2)=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CC=C(OC2=CC=CC=C2)C=C1.CCOC(C)=O.O.O=C([O-])[O-].O=CC1=CC2=NC=CC(Cl)=C2S1.O=[N+]([O-])C1=CC=C(O)C(F)=C1.[K+] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be O=CC1=CC2=NC=CC(OC3=CC=C([N+](=O)[O-])C=C3F)=C2S1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1=CC=C(C2=CC=CC=C2P(C2CCCCC2)C2CCCCC2)C=C1.CCOC(C)=O.COCCOC.Cl.N=C(C1=CC=CC=C1)C1=CC=CC=C1.O=C(/C=C/C1=CC=CC=C1)/C=C/C1=CC=CC=C1.O=C([O-])C1=C(OS(=O)(=O)C(F)(F)F)C=CC2=CC=CC=C12.O=P([O-])([O-])[O-].[K+].[Na+].[OH-].[Pd] ",
"input": "",
"output": " COC(=O)C1=CC=CC2=CC(N)=CC=C12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " COP(=O)(CC(=O)C1=CC=C(Cl)C=C1C)OC.NN.O.O=C1C(=O)C2CCC1C2 Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CC1=CC(Cl)=CC=C1C1=CC2=C(N=N1)[C@H]1CC[C@@H]2C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CP(=O)(O)CC1=CC=C(CP(C)(=O)O)C=C1.O=C(Cl)Cl as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CP1(=O)CC2=CC=C(C=C2)CP(C)(=O)O1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CCO.CCOC1=C(OCC)C(=O)C1=O.NC1=CC=C(Cl)C=C1 ",
"input": "",
"output": " CCOC1=C(NC2=CC=C(Cl)C=C2)C(=O)C1=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC1=C(C)C(=O)N2C=CC=C(C)C2=N1.CO.COC1=CC(C(C)=O)=CC(OC)=C1OC.C[O-].[Na+] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be COC1=CC(C(C)=CC2=C(C)C(=O)N3C=CC=C(C)C3=N2)=CC(OC)=C1OC .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCOC(=O)NC1=CC=CC=C1.O=S(=O)(O)Cl Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CCOC(=O)NC1=CC=C(S(=O)(=O)Cl)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC1=CC=C(S(=O)(=O)O)C=C1.CCN=C=NCCCN(C)C.ClC(Cl)Cl.NC1=CC=CC=C1O.O.O=C(O)C1=CC([N+](=O)[O-])=C(F)C=C1Cl ",
"input": "",
"output": " O=[N+]([O-])C1=CC(C2=NC3=CC=CC=C3O2)=C(Cl)C=C1F ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CCOC(=O)C(C)(C)Br.CN(C)C=O.O.O=C([O-])[O-].OC1=CC=CC(C2=CC=CN=C2)=C1.[K+] ",
"input": "",
"output": " CCOC(=O)C(C)(C)OC1=CC=CC(C2=CC=CN=C2)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CC=NC=C1.CC(=O)OC(C)=O.CC1(C)C(=O)C2=C(Cl)C=CC=C2C1O.CCO.ClCCl.O.[BH4-].[Cl-].[NH4+].[Na+] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CC(=O)OC1C2=CC=CC(Cl)=C2C(O)C1(C)C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.C=CC(C)(C)C(=O)OC(C(=O)OCC)C1COC1.CO.Cl.O.O=C([O-])[O-].[K+] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be C=CC(C)(C)C(=O)OC(C(=O)O)C1COC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC(C)C[Al+]CC(C)C.CC(C)OC(=O)CC1=CN=C2[C@H](NC(=O)OC(C)(C)C)CC[C@@H](C3=CC=CC(F)=C3F)CN12.ClCCl.O=C([O-])C(O)C(O)C(=O)[O-].[H-].[K+].[Na+] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC(C)(C)OC(=O)N[C@@H]1CC[C@@H](C2=CC=CC(F)=C2F)CN2C(CC=O)=CN=C12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC#N.O=C(O)[C@@H]1CCCN1.O=NC1=CC=CC=C1.O=O is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " O=CCCC1=CC=CC=C1[N+](=O)[O-] ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC(C)C#N.CC1=CC=CC=C1.COC1=CC(F)=CC=C1Cl.C[Si](C)(C)[N-][Si](C)(C)C.Cl.[K+] ",
"input": "",
"output": " COC1=CC(C(C)(C)C#N)=CC=C1Cl ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C1CCOC1.COC(=O)Cl.COCOC1=CC=CC(C(F)(F)F)=C1Cl.O=C([O-])O.[Li]CCCC.[Na+] , what product could potentially be produced?",
"input": "",
"output": "The product can be COC(=O)OC1=C(C(=O)OC)C=CC(C(F)(F)F)=C1Cl .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CC=C(P(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.C1CCOC1.CC(C)OC(=O)N=NC(=O)OC(C)C.CCOCC.COC1=CC=C(S(=O)(=O)NC2=CC=C(Cl)C=C2CC2=C(F)C=CC=C2F)C=C1OC.OCCCC1=CC=CN=C1 Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be COC1=CC=C(S(=O)(=O)N(CCCC2=CC=CN=C2)C2=CC=C(Cl)C=C2CC2=C(F)C=CC=C2F)C=C1OC .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C1CCOC1.CCO.N#CCC1=CN=C(C2=CC=C(C(CC3CCOCC3)C3=CC=C(S(=O)(=O)C4CC4)C=C3)N2)S1.O.[Na+].[OH-] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " O=C(O)CC1=CN=C(C2=CC=C(C(CC3CCOCC3)C3=CC=C(S(=O)(=O)C4CC4)C=C3)N2)S1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) COC1=CC=C(C2=NC=NC3=C2NC=C3C(=O)N[C@H]2CC[C@H](N)CC2)C(OCC2CC2)=C1.COCC(=O)Cl as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: COCC(=O)N[C@H]1CC[C@H](NC(=O)C2=CNC3=C(C4=CC=C(OC)C=C4OCC4CC4)N=CN=C23)CC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. COC1=CC=C(C2=NC=NC3=C2NC=C3C(=O)N[C@H]2CC[C@@H](N)CC2)C(OCC2CC2)=C1.COCC(=O)Cl ",
"input": "",
"output": " COCC(=O)N[C@H]1CC[C@@H](NC(=O)C2=CNC3=C(C4=CC=C(OC)C=C4OCC4CC4)N=CN=C23)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CCCCN1C=CC(OS(=O)(=O)C(F)(F)F)=C(Cl)C1=O.O=C1C(Cl)=C(O)C=CN1CC1CC1 as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " O=C1C(Cl)=C(OS(=O)(=O)C(F)(F)F)C=CN1CC1CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1=COC(P(C2=CC=CO2)C2=CC=CO2)=C1.C1COCCO1.CC(C)(C)C1=CC=C(B(O)O)C=C1.CCOC(C)=O.COC1=NC(/C(I)=C/CO)=CC=C1Cl.O.O=C(/C=C/C1=CC=CC=C1)/C=C/C1=CC=CC=C1.O=C([O-])[O-].[Cs+].[Pd] ",
"input": "",
"output": " COC1=NC(/C(=C/CO)C2=CC=C(C(C)(C)C)C=C2)=CC=C1Cl ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1=CC=NC=C1.CCN(CC)CC.CCOC(=O)CC1=CSC(NC(=O)CN(C)C2=NC=CC(N3C=C(C4C5=CC=C(C)C=C5C=CC5=CC(CC)=CC=C54)C(SC)=NC3=O)=N2)=N1 as the reactants and reagents.",
"input": "",
"output": " CCOC(=O)CC1=CSC(NC(=O)CN(C)C2=NC=CC(N3C=C(C4C5=CC=C(C)C=C5C=CC5=CC(CC)=CC=C54)C(=S)NC3=O)=N2)=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CO.ClC(Cl)Cl.N#CCCCCOC1=CC=CC(CN2CCCCC2)=C1 Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " COC(=N)CCCCOC1=CC=CC(CN2CCCCC2)=C1.Cl ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)(C)OC(=O)NC(C)(/C=C\\CC#N)C(=O)[O-].Cl.O.[K+] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CC(N)(/C=C\\CC#N)C(=O)O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CCC(=O)Cl.CCCCCCCCCCCCC1=CC=CC=C1.Cl.ClC(Cl)(Cl)Cl.[Al+3].[Cl-] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CCCCCCCCCCCCC1=CC=C(C(=O)CC)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CO.COC(=O)C(OC1=CC(OC)=CC=C1Cl)C(=O)OC.NC(N)=S as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " COC1=CC=C(Cl)C(OC2=C(O)N=C(SC)N=C2O)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1CCOC1.CCCCCC.NC1=NC=CC=C1C1=CC=C(OC2=CC=CC=C2)C=C1.O.O=S(=O)(Cl)CCCl.[H-].[Na+] ",
"input": "",
"output": " O=S1(=O)CCN2C=CC=C(C3=CC=C(OC4=CC=CC=C4)C=C3)C2=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CCOC(=N)C1=CC=C(C(=O)NC2=CC=C(Cl)C(C3=CC=CC=N3)=C2)C=C1.CO.NCCCC1=CNC=N1 ",
"input": "",
"output": " N=C(NCCCC1=CNC=N1)C1=CC=C(C(=O)NC2=CC=C(Cl)C(C3=CC=CC=N3)=C2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C1CCOC1.O.O=C(O)C1=CC=CC2=C1OC(C1=CC=CC=C1)=C2.[Al+3].[H-].[Li+] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " OCC1=CC=CC2=C1OC(C1=CC=CC=C1)=C2 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CC(C)(C)O.CC(C)(C)OC(=O)OC(=O)OC(C)(C)C.CN(C)C1=CC=NC=C1.COC(=O)C1=CC(N)=NC=C1Br as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " COC(=O)C1=CC(N(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C)=NC=C1Br ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CCI.CCOC(C)=O.CN(C)C=O.COC(=O)C1=CC=C2OC(C)C(=O)NC2=C1.O.[H-].[Na+] ",
"input": "",
"output": " CCN1C(=O)C(C)OC2=CC=C(C(=O)OC)C=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C[C@]1(F)COC(N)=N[C@]1(C)C1=CC(N)=CC=C1F.O=C(O)C1=NN(C(F)F)C=C1Cl ",
"input": "",
"output": " C[C@]1(F)COC(N)=N[C@]1(C)C1=CC(NC(=O)C2=NN(C(F)F)C=C2Cl)=CC=C1F ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC(C)(C)OC(=O)CBr.CC1=C(C2=CC=CN=C2)NC2=CC=C(C#N)C=C12 .",
"input": "",
"output": " CC1=C(C2=CC=CN=C2)N(CC(=O)OC(C)(C)C)C2=CC=C(C#N)C=C12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CCOCC.NC1=CC=C2OCC(=O)NC2=C1.O=C(O)C(=O)N1CCC(CC2=CC=CC=C2)CC1 ",
"input": "",
"output": " O=C1COC2=CC=C(NC(=O)C(=O)N3CCC(CC4=CC=CC=C4)CC3)C=C2N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C.CCN(CC)CCOC1=CC=C(C=CC(=O)N[C@H]2CC[C@H](C)CC2)C=C1OC.CO.[Pd] ",
"input": "",
"output": " CCN(CC)CCOC1=CC=C(CCC(=O)N[C@H]2CC[C@H](C)CC2)C=C1OC ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CCCCC1=NC(F)=C(CC(=O)O)N1CC1=CC=CC=C1Cl.CCCSC1=NC=C(C(=O)O)N1CC1=CC=CC=C1Cl.COC(=O)[C@@H](N)CC1=CC=CC=C1.Cl ",
"input": "",
"output": " CCCCC1=NC(F)=C(CC(=O)N[C@@H](CC2=CC=CC=C2)C(=O)O)N1CC1=CC=CC=C1Cl ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C1CCOC1.CC(=O)CC(=O)OC(C)(C)C.CC(C)C(C=CC=O)=C(C1=CC=C(F)C=C1)C1=CC=C(F)C=C1.[H-].[Li]CCCC.[Na+] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CC(C)C(C=CC(O)CC(=O)CC(=O)OC(C)(C)C)=C(C1=CC=C(F)C=C1)C1=CC=C(F)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1CCNCC1.C1CCOC1.COC(=O)C(Br)C1=CC=C(OC)C=C1 ",
"input": "",
"output": " COC(=O)C(C1=CC=C(OC)C=C1)N1CCCCC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC(C)(C)OC(=O)NC1(C2=CC=C(C3=C(Br)N=C4C5=CC=CC=C5NC5=NC=CC=C5N43)C=C2)CCC1.CC1(C)OB(C2=CNN=C2)OC1(C)C.CCOC(C)=O.CN(C)C1=CC=C(P(C(C)(C)C)C(C)(C)C)C=C1.CN(C)C=O.Cl[Pd]Cl.O.O=P([O-])([O-])[O-].[K+] , what product could potentially be produced?",
"input": "",
"output": "The product can be NC1(C2=CC=C(C3=C(C4=CNN=C4)N=C4C5=CC=CC=C5NC5=NC=CC=C5N43)C=C2)CCC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CCN(CC)S(F)(F)F.ClCCl.O=[N+]([O-])C1=CC=C(CCCO)C(C(F)(F)F)=C1 ",
"input": "",
"output": " O=[N+]([O-])C1=CC=C(CCCF)C(C(F)(F)F)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC(=O)O.CC(C)(C)OC(=O)[C@@H](N)CC1=CC=CC=C1.ClCCl.O.O=C([O-])OC1=CC=C([N+](=O)[O-])C=C1CC1C2=C(C3=C1C1=CC=CC=C1C1=CC=CC=C31)C1=CC=CC=C1C1=CC=CC=C21.O=S(=O)([O-])O.[K+] ",
"input": "",
"output": " CC(C)(C)OC(=O)[C@H](CC1=CC=CC=C1)NC(=O)OCC1C2=C(C3=C1C1=CC=CC=C1C1=CC=CC=C31)C1=CC=CC=C1C1=CC=CC=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " BrC1CCC1.Br[Cu]Br.Br[Mg]C1CCC1.C1CCOC1.CC(C)(C)[Si](C)(C)OC1=CC=C(C#N)C(F)=C1.CCOCC.Cl.II.O.[MgH2] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " O=C(C1=CC=C(O)C=C1F)C1CCC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CCNS(C)(=O)=O.CN(C)C=O.O.O=[N+]([O-])C1=CC=C(F)C=C1F.[H-].[Na+] ",
"input": "",
"output": " CCN(C1=CC(F)=CC=C1[N+](=O)[O-])S(C)(=O)=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1CCOC1.CCO.CCOC(C)=O.COC1=CC(C2=NOC3=C2CCCC3=O)=CC=C1N1C=NC(C)=C1.O.[BH4-].[Na+] ",
"input": "",
"output": " COC1=CC(C2=NOC3=C2CCCC3O)=CC=C1N1C=NC(C)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCN1CCOC(C2=CC=C(N)C=C2)C1.CN(C1=CC=CC=C1C1=CC=C2C=NC(S(C)=O)=NN12)S(C)(=O)=O Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CCN1CCOC(C2=CC=C(NC3=NN4C(C5=CC=CC=C5N(C)S(C)(=O)=O)=CC=C4C=N3)C=C2)C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) ClCCl.NCCC1=CC=CC=C1.O=C1CC(=CC2=CC=CC3=CC=CC=C23)C(=O)O1 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: O=C(CC(=CC1=CC=CC2=CC=CC=C12)C(=O)O)NCCC1=CC=CC=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC(=O)CC(C)C.ClC1=CC=C2C(=C1)C=CN2C1=CC=NC=C1.ICCC1CC2=CC=CC=C2C1 ",
"input": "",
"output": " ClC1=CC=C2C(=C1)C=CN2C1=CCN(CCC2CC3=CC=CC=C3C2)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " COC(=O)C1=CC=C([N+](=O)[O-])C=C1Br.COCCOC.ClCCl.O=C([O-])[O-].OB(O)C1=CC=CC=C1F.[K+] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be COC(=O)C1=CC=C([N+](=O)[O-])C=C1C1=CC=CC=C1F .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CCOC(=O)C(C)=CC1=C(C)CCC1C(C)C.CCOCC.O.[Al+3].[H-].[Li+] ",
"input": "",
"output": " CC(=CC1=C(C)CCC1C(C)C)CO ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CI.CN(C)C=O.N#CCC#N.O.S=C=NCC1=CC=CC=C1.[H-].[Na+] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CSC(NCC1=CC=CC=C1)C(C#N)C#N .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1CCOC1.CCC(C=O)C1=CC=C(Cl)C2=C1N1CCCN(C3=CC=C(Cl)C=C3Cl)C1=N2.CCCC[N+](CCCC)(CCCC)CCCC.CCOC(C)=O.C[Si](C)(C)C(F)(F)F.Cl.[F-] ",
"input": "",
"output": " CCC(C1=CC=C(Cl)C2=C1N1CCCN(C3=CC=C(Cl)C=C3Cl)C1=N2)C(O)C(F)(F)F ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C=C[N+](=O)[O-].Cl.ClCCl.N#CSCCl.O.O=C([O-])C1=CC=CS1.O=CCCl.[K+].[OH-] .",
"input": "",
"output": " N#CSCSC1=C([N+](=O)[O-])C=CS1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1COCCO1.CC(=O)[O-].CC1(C)C2=CC=CC(P(C3=CC=CC=C3)C3=CC=CC=C3)=C2OC2=C(P(C3=CC=CC=C3)C3=CC=CC=C3)C=CC=C21.CC1=NN(C)C=C1NC1=CC(I)=C(C(F)(F)F)C=N1.CONC(=O)C1=C(N)C=CC=C1OC.O=C([O-])[O-].[Cs+].[Pd+2] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CONC(=O)C1=C(NC2=CC(NC3=CN(C)N=C3C)=NC=C2C(F)(F)F)C=CC=C1OC ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. O=C1CC2=CC=CN=C2N1.O=CC1=CC=C2C(/C=C/C3=CC=CN=C3)=NNC2=C1 ",
"input": "",
"output": " O=C1NC2=NC=CC=C2C1=CC1=CC=C2C(/C=C/C3=CC=CN=C3)=NNC2=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C=C(C)CCl.CC(C)(C)[O-].CS(C)=O.O.OCC1=CC=CO1.[K+] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be C=C(C)COCC1(C)CC=CO1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC1=CC=C(S(=O)(=O)O)C=C1.CCO.CCOC(=O)CC(C(C)=O)C(=O)C1=CC=C(F)C=C1.CCOC(C)=O.NN1C=CC=C1.O ",
"input": "",
"output": " CCOC(=O)CC1=C(C2=CC=C(F)C=C2)C2=CC=CN2N=C1C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.CC(C)=O.CCOC(C)=O.CCOCC.COC(=O)CCC(=O)C1=CNC2=CC=C(Cl)C=C12.Cl.FB(F)F.[BH4-].[Na+] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " COC(=O)CCCC1=CNC2=CC=C(Cl)C=C12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1CCC2=NCCCN2CC1.CC(C)(C)OC(=O)C=C1C[C@@H]2CC=C[C@H]12.C[N+](=O)[O-].Cl ",
"input": "",
"output": " CC(C)(C)OC(=O)C[C@]1(C[N+](=O)[O-])C[C@@H]2CC=C[C@@H]21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCC2=NCCCN2CC1.CC(C)(C)OC(=O)C=C1CC2CC=CC12.C[N+](=O)[O-].Cl Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CC(C)(C)OC(=O)CC1(C[N+](=O)[O-])CC2CC=CC21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC(C)(C)OC(=O)N1C=C(C2=CC3=CN=C(Br)C=C3N2C(=O)OC(C)(C)C)C=N1.COC1=CC=C(N)C=C1OC as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: COC1=CC=C(NC2=CC3=C(C=N2)C=C(C2=CN(C(=O)OC(C)(C)C)N=C2)N3C(=O)OC(C)(C)C)C=C1OC .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)=O.CC1=CC=CC=C1C=O.CCOC(C)=O.O.[Na+].[OH-] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CC(=O)C=CC1=CC=CC=C1C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " BrCCCBr.CCN(CC)C1=CC=C(F)C2=C1NC(NC1=CC=C(Cl)C=C1Cl)=N2.CCOC(C)=O.CN(C)C=O.O=C([O-])[O-].[K+] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CCN(CC)C1=CC=C(F)C2=C1N1CCCN(C3=CC=C(Cl)C=C3Cl)C1=N2 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CCOC(=O)CCCCCCCCCCOCC(C)(C)C1=C(C2=CC=CC(OC(C)=O)=C2)OCC1(C)C.ClCCl.O=O.[NaH] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CCOC(=O)CCCCCCCCCCOCC(C)(C)C12OOC1(C1=CC=CC(OC(C)=O)=C1)OCC2(C)C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC(=O)C1=CC2=CC(N)=CN=C2N1.CC(=O)O.CO.O=CC1=CC=CC(C(=O)NC2=CC=CN=C2)=C1.[BH3-]C#N.[Na+] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC(=O)C1=CC2=CC(NCC3=CC=CC(C(=O)NC4=CC=CN=C4)=C3)=CN=C2N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CCCCCC.CCOCC.N#CCSCCC1=CC=C2OCOC2=C1.O.O=C=O.[Li]CCCC ",
"input": "",
"output": " N#CC(SCCC1=CC=C2OCOC2=C1)C(=O)O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CCOC(=O)C1=CC2=CC=CC=C2N1.CN(C)CCOC1=CC=C(C(O)C2=CC=CC=C2)C=C1 .",
"input": "",
"output": " CCOC(=O)C1=C(C(C2=CC=CC=C2)C2=CC=C(OCCN(C)C)C=C2)C2=CC=CC=C2N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C=CC=COC(C)=O.CC1=CC=CC=C1.COC(=O)C1(C(=O)OC)CC2=C(CO1)C(=O)C=CC2=O Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be COC(=O)C1(C(=O)OC)CC2=C(CO1)C(=O)C1=CC=CC=C1C2=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " BrC1=CSC(C#CC2=CC=C(OCCN3CCCC3)C=C2)=C1.C1COCCO1.O=C([O-])[O-].OB(O)OC1=CC=C(Cl)C=C1.[Na+] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " ClC1=CC=C(C2=CSC(C#CC3=CC=C(OCCN4CCCC4)C=C3)=C2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC1(C)CC(CCBr)CCO1.CCC[C@H](C)OC1=NC2=NC(OC)=NC2=C(N)N1.O=C(O)C(F)(F)F ",
"input": "",
"output": " CCC[C@H](C)OC1=NC(N)=C2N=C(OC)N(CCC3CCOC(C)(C)C3)C2=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1CCC2=NCCCN2CC1.CC1=NN=C(C2=CC3=NC=CN3C(C3=CNN=C3)=N2)S1.CCOC(C)=O.CN(C)C=O.N#CC=CC1CC1 as the reactants and reagents.",
"input": "",
"output": " CC1=NN=C(C2=CC3=NC=CN3C(C3=CN(C(CC#N)C4CC4)N=C3)=N2)S1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CCN(CC)CC.CO.CS(C)=O.ClCCl.O=C(Cl)C(=O)Cl.O=C([O-])O.OCC12CC1CCN(CC1=CC=CC=C1)C2.[Na+] ",
"input": "",
"output": " O=CC12CC1CCN(CC1=CC=CC=C1)C2 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC(=O)OC(C)=O.COC(=O)CC(NC(=O)C1=CC=C(C)C(Br)=C1)C(C)=O.O=S(=O)(O)O ",
"input": "",
"output": " COC(=O)CC1=C(C)OC(C2=CC=C(C)C(Br)=C2)=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C#CCNC.C1=CC=C([PH](C2=CC=CC=C2)(C2=CC=CC=C2)[Pd]([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)[PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.CC(=O)C1=CNC(/C=C2\\C(=O)NC3=CC=C(F)C(I)=C23)=C1.CCN(CC)CC.CN(C)C=O.[Cu]I as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CNCC#CC1=C(F)C=CC2=C1/C(=C/C1=CC(C(C)=O)=CN1)C(=O)N2 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC1=CC=CC=C1.COC1=CC2=NC=CC(OC3=CC=C(N)C=C3)=C2C=C1OC.O.O=C=NC1CCCCC1 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " COC1=CC2=NC=CC(OC3=CC=C(NC(=O)NC4CCCCC4)C=C3)=C2C=C1OC ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CCOC(C)=O.CN(C)C=O.O=C([O-])[O-].O=C1CCC(=O)O1.OCC1=CC=CC=C1.[Cs+] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: O=C(O)CCC(=O)OCC1=CC=CC=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CCNC(=O)[C@H]1O[C@@H](N2C=NC3=C(NCC(C4=CC=CC=C4)C4=CC=CC=C4)N=C(Cl)N=C32)[C@@H]2OC(C)(C)O[C@@H]21.O.O=C(O)C(F)(F)F as the reactants and reagents.",
"input": "",
"output": " CCNC(=O)[C@H]1O[C@@H](N2C=NC3=C(NCC(C4=CC=CC=C4)C4=CC=CC=C4)N=C(Cl)N=C32)[C@H](O)[C@@H]1O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CCO.CCOC(=O)C(O)CC(=O)C1=CC=C(OC)C=C1.NN as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " COC1=CC=C(C2=CC=C(O)N=N2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC(C)(C)NC1=CC=C(C2=CN=C(N)N=C2)C=C1N.CN(C)C=O.COC1=CC=C(N2C=CC(C)=N2)C(C=O)=C1.O.O=S([O-])([O-])=S.O=S([O-])OO.[K+].[Na+] ",
"input": "",
"output": " COC1=CC=C(N2C=CC(C)=N2)C(C2=NC3=CC(C4=CN=C(N)N=C4)=CC=C3N2C(C)(C)C)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C1CCOC1.CC(C)(C)[O-].CC1=CC(NC2=NC=CC(C(F)(F)F)=N2)=CC(C2=CN=C(C=O)S2)=C1.COC[P+](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1.[Cl-].[K+] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CO/C=C/C1=NC=C(C2=CC(C)=CC(NC3=NC=CC(C(F)(F)F)=N3)=C2)S1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCCC(=O)C1=CC2=C(C=C1C)NC(=O)C2(O)C(=O)OCC.CO.[Na+].[OH-] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CCCC(=O)C1=CC(C(=O)O)=C(N)C=C1C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC#N.CC(C)(C)OC(=O)N1CC[C@@H](CN)[C@H](O)C1.COC1=C(C(=O)N2C=CN=C2)C=C(Cl)C(N)=C1OC Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " COC1=C(C(=O)NC[C@@H]2CCN(C(=O)OC(C)(C)C)C[C@H]2O)C=C(Cl)C(N)=C1OC ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCCCCCCCCCCCCCCCCCO.NC(=O)N1C(=O)C=CC1=O Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CCCCCCCCCCCCCCCCCCOC(=O)/C=C\\C(=O)NC(N)=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C1=CC=CC=C1.Cl.NCCCl.SC1=NCCS1 .",
"input": "",
"output": " NCCSC1=NCCS1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CC(=O)C1=CC=CO1.CN(C)C=O.O.O=C1CCC(=O)N1Br as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CC(=O)C1=CC=C(Br)O1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C1=CC=C([PH](C2=CC=CC=C2)(C2=CC=CC=C2)[Pd]([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)[PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.C1CCOC1.CC(=O)O.CC(=O)O[C@@H]1C=C[C@H](N(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C)C1.CC(C)O.[BH4-].[Na+] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CC(C)(C)OC(=O)N(C(=O)OC(C)(C)C)[C@H]1C=CCC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: O=C=O.OC1=CC=CC(C2=CC(O)=CC(O)=C2)=C1.OCC(O)CO .",
"input": "",
"output": " COC(=O)C1=C(O)C=C(C2=CC=CC(O)=C2)C=C1O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C1CCC2=NCCCN2CC1.COC(=O)C(NC(=O)OC(C)(C)C)P(=O)(OC)OC.ClCCl.O=CC1=CC=C2O[C@H](C3=CC=C(OCC4=CC=C(Cl)C(Cl)=C4)C=C3)COC2=C1 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: COC(=O)C(=CC1=CC=C2O[C@H](C3=CC=C(OCC4=CC=C(Cl)C(Cl)=C4)C=C3)COC2=C1)NC(=O)OC(C)(C)C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C1=CC=C(P(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.CC(C)(C)OC(=O)[C@@H](N1CC(=O)NC1=O)C(C)(C)C.CC1=CC=CC(CO)=N1.CCOC(=O)N=NC(=O)OCC.ClCCl.O .",
"input": "",
"output": " CC1=CC=CC(CN2C(=O)CN([C@H](C(=O)OC(C)(C)C)C(C)(C)C)C2=O)=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.CCO.CCOC(=O)C1=COC(C2=C(C(=O)OCC)C(CCC3=CC=C(C(F)(F)F)C=C3)=NC3=C2C(=O)N2CCCN32)=N1.[Na+].[OH-] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CCOC(=O)C1=C(CCC2=CC=C(C(F)(F)F)C=C2)N=C2C(=C1C1=NC(C(=O)O)=CO1)C(=O)N1CCCN21 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CCOC(=O)C#CC(=O)CC(C)C.C[Si](C)(C)C=[N+]=[N-] ",
"input": "",
"output": " CCOC(=O)C1=C(C(=O)CC(C)C)NN=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC(C)(C#N)C1=CC(I)=CC=N1.CC1=CSC(NC(=O)OC(C)(C)C)=N1.CCOC(C)=O is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC1=C(C2=CC=NC(C(C)(C)C#N)=C2)SC(NC(=O)OC(C)(C)C)=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. COC1=CC=C(B2OC(C)(C)C(C)(C)O2)C=N1.COC1=CC=C(C2=NC3=C(C=C2F)CN(C(C)=O)C2=CC=CC=C2C=C3)C=N1 ",
"input": "",
"output": " COC1=CC=C(C2=CC=C3CN(C(C)=O)C4=CC=CC=C4C=CC3=N2)C=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC(=O)NC1=CC=C(SC2=CC=C(C)C=C2N)C=C1.CCCC1=CC=C2C(Cl)=CC=NC2=N1 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CCCC1=CC=C2C(NC3=CC(C)=CC=C3SC3=CC=C(NC(C)=O)C=C3)=CC=NC2=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CC=NC=C1.CC(=O)OC(C)=O.C[C@H]1COCCN1C1=NC(N2CCOC[C@@H]2C)=C2C=CC(C3=CC=NC(N)=C3)=NC2=N1 Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CC(=O)NC1=CC(C2=CC=C3C(N4CCOC[C@@H]4C)=NC(N4CCOC[C@@H]4C)=NC3=N2)=CC=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CCOC(=O)C(C)CC(N)C1=C(OC)C=CC=C1OC.O=CC1=CC=C2C=CC=CC2=N1 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " COC1=CC=CC(OC)=C1C1CC(C)C(=O)N1CC1=CC=C2C=CC=CC2=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C1COCCO1.CC(=O)[O-].COC(C)(C)C.COC1=CC=CC(OC)=C1C1=CC=CC=C1P(C1CCCCC1)C1CCCCC1.COCC1=CC(C(=O)O)=CC=C1C1=CC=CC(F)=C1C.COCC1=CC(C(=O)OC)=CC=C1Br.O.OB(O)C1=CC=CC(F)=C1Cl.[Cs+].[F-].[Pd+2] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: COCC1=CC(C(=O)OC)=CC=C1C1=CC=CC(F)=C1Cl .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CN(C)C=O.COC1=CC=CC(C2=CN=CN2COCC[Si](C)(C)C)=C1.[Li]CCCC is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " COC1=CC=CC(C2=CN=C(C=O)N2COCC[Si](C)(C)C)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CNC(C)(C)C.COC(=O)CS(=O)(=O)Cl Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be COC(=O)CS(=O)(=O)N(C)C(C)(C)C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C#CCN1C(=O)CCC2=CC=CC=C21.C1=CC=C(P(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.CC(=O)[O-].CC1=NN=C2CN=C(C3=CC=CC=C3F)C3=CC(I)=CC=C3N12.CCN(CC)CC.CN(C)C=O.[Pd+2] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CC1=NN=C2CN=C(C3=CC=CC=C3F)C3=CC(C#CCN4C(=O)CCC5=CC=CC=C54)=CC=C3N12 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C1=CC=C(C2CCNCC2)C=C1.CCN(CC)CC.CN(C)C=O.ClCCl.O=C(Cl)C(=O)Cl.O=C(O)C1CN(CC2=CC=CC=C2)CC12CCCC1=CC=CC=C12 .",
"input": "",
"output": " O=C(C1CN(CC2=CC=CC=C2)CC12CCCC1=CC=CC=C12)N1CCC(C2=CC=CC=C2)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC1=C(N)C=CC=C1Br.CCCC=O.CCCNC1=CC=CC(Br)=C1C ",
"input": "",
"output": " CCCCNC1=CC=CC(Br)=C1C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CC1=CC=C(N)N=C1.CCOC(=O)CC(=O)OCC.COCCBr as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: COCCC(O)C(=O)NC1=CC=C(C)C=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC1=CC=C(C2=CC=C(F)C=C2)C(C(=O)N2CCC[C@@H](C)[C@H]2CN)=N1.CC1=CC=C(C2=CN(C)N=C2)C(C(=O)N2CCC[C@@H](C)[C@H]2CNC2=CC=C(C(F)(F)F)C=N2)=C1 Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CC1=CC=C(C2=CC=C(F)C=C2)C(C(=O)N2CCC[C@@H](C)[C@H]2CNC2=CC=C(C(F)(F)F)C=N2)=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCNCC1.CC1=CC(C)=C(CNC(=O)C2=CC(Cl)=NC3=C2C=NN3C(C)C)C(=O)N1.CCO.O Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CC1=CC(C)=C(CNC(=O)C2=CC(N3CCCCC3)=NC3=C2C=NN3C(C)C)C(=O)N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC1=CC=CC(C(=O)Cl)=C1.N#CC1=CC=C(O)N=C1O as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CC1=CC=CC(C(=O)OC2=CC=C(C#N)C(O)=N2)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " COC(=O)C(CC1=CC=C(C(C)(C)O[SiH2]C(C)(C)C)C=C1)SCCC1=CC=C(F)C=C1.FC1=CC=C(CCS)C=C1.O=C(OCC(Cl)(Cl)Cl)C(Cl)CC1=CC=C(CCO)C=C1 Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be O=C(OCC(Cl)(Cl)Cl)C(CC1=CC=C(CCO)C=C1)SCCC1=CC=C(F)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C=CCOC1=CC2=C(NC3=CC=C(Cl)C=C3)N=CN=C2C=C1OC.CC1=CC=CC=C1C Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " C=CCC1=C(O)C(OC)=CC2=NC=NC(NC3=CC=C(Cl)C=C3)=C12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CCCCCCC(C(C)=O)C1=NC(C)=C2C(=O)NC(CC3=CC=C(OC)C=C3)=NN12.[BH4-].[Na+] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CCCCCCC(C1=NC(C)=C2C(=O)NC(CC3=CC=C(OC)C=C3)=NN12)C(C)O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC(=O)NCCC1=CC=C(F)C=C1OCCOC1CN(C(=O)OC(C)(C)C)CCC1C1=CC=C(OCC2=CC=CC=C2)C=C1.CCOC(C)=O.[Pd] , what product could potentially be produced?",
"input": "",
"output": "The product can be CC(=O)NCCC1=CC=C(F)C=C1OCCOC1CN(C(=O)OC(C)(C)C)CCC1C1=CC=C(O)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CN(C)C=O.ClCCl.NC(=O)C1=C(N)SC2=C1CCCC2.O=C(O)CC1=CC=CC=C1.OC1=CC=CC2=C1N=NN2.ON1N=NC2=CC=CC=C21 Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be NC(=O)C1=C(NC(=O)CC2=CC=CC=C2)SC2=C1CCCC2 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC#N.CCN(CC)CC.CCN(CC)CCN.O=S(=O)(Cl)C1=CC=C(F)C2=N[Se]N=C12 ",
"input": "",
"output": " CN(C)CCNS(=O)(=O)C1=CC=C(F)C2=N[Se]N=C12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CC(=O)N(C)C.CCCCC(C)(C)/C=C/[C@H](OC1CCCCO1)[C@H]1[C@H](C)CC(O)[C@@H]1C/C=C\\CCCC(=O)O.CI.O.O=C([O-])O.[Na+] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CCCCC(C)(C)/C=C/[C@H](OC1CCCCO1)[C@H]1[C@H](C)CC(O)[C@@H]1C/C=C\\CCCC(=O)OC .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: COCOCCN(CCOCOC)CCOCOC.ClCCl.O=C(OO)C1=CC=CC(Cl)=C1 .",
"input": "",
"output": " COCOCC[N+]([O-])(CCOCOC)CCOCOC ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CN(C)C=O.O.O=C1CCC(=O)N1Cl.ON=CC1=CC=C(Cl)C(I)=C1F Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be ON=C(Cl)C1=CC=C(Cl)C(I)=C1F .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CCS(=O)(=O)Cl.ClC1=CC=C(NCC2=CC=CN=C2)C=C1.ClCCl.O=C([O-])[O-].[K+] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CCS(=O)(=O)N(CC1=CC=CN=C1)C1=CC=C(Cl)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CO.O=C(O)C(O)C1=CC=C(O)C(O)=C1.O=S(=O)(O)O ",
"input": "",
"output": " COC(=O)C(O)C1=CC=C(O)C(O)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CN(C)C=O.CN1N=CN=C1CCl.O.O=C([O-])[O-].O=C1NC2=C(C3=CC=CC=C3)N=NC=C2C=C1C1=CC=CC=C1.[Cs+] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CN1N=CN=C1COC1=NC2=C(C3=CC=CC=C3)N=NC=C2C=C1C1=CC=CC=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CN(C)C=O.ClCCl.O=C(O)C1=CC=C(NC2=NC(C3=CC=CC=C3)=C3C=CC=CC3=N2)C=C1.O=S(Cl)Cl .",
"input": "",
"output": " O=C(Cl)C1=CC=C(NC2=NC(C3=CC=CC=C3)=C3C=CC=CC3=N2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC1=CC=CC=C1.CN1CCC(C(=O)O)(C2=CC=C(F)C=C2)CC1.Cl.[N-]=[N+]=NP(=O)(C1=CC=CC=C1)C1=CC=CC=C1.[Na+].[OH-] ",
"input": "",
"output": " CN1CCC(N)(C2=CC=C(F)C=C2)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC(C)(C)[O-].CN(C)C=O.COC1=CC=C([N+](=O)[O-])C=C1F.N#CCOC1=CC=C(Cl)C=C1.[K+] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: [C-]#[N+]CC1=CC(OC)=C(F)C=C1[N+](=O)[O-] .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)(C)OC(=O)N[C@@H](CC1=CC=CC=C1)C[C@H](O)[C@@H](N)CC1=CC=CC=C1.CC1=CC=CC(C)=C1OCC(=O)Cl.CCOC(C)=O.O.O=C([O-])CCC(=O)[O-].O=C([O-])O.[Na+] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CC1=CC=CC(C)=C1OCC(=O)N[C@@H](CC1=CC=CC=C1)[C@@H](O)C[C@H](CC1=CC=CC=C1)NC(=O)OC(C)(C)C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC(C)C(=O)NC1=CC=CC(C2CCN(CC[C@H](N)C3=CC=CC=C3)CC2)=C1.O=C=NC1=CC=CC=C1 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC(C)C(=O)NC1=CC=CC(C2CCN(CC[C@H](NC(=O)NC3=CC=CC=C3)C3=CC=CC=C3)CC2)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCC(=O)CCC(=O)O.Cl.NNC1=CC=CC=C1 Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CCC1=C(CC(=O)O)C2=CC=CC=C2N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1CCOC1.CC(=O)OC(C)=O.COC(=O)C(F)(Cl)Cl.Cl[Cu].O=CC1(C2=CC=C(F)C=C2F)CC1.[Zn] as the reactants and reagents.",
"input": "",
"output": " COC(=O)C(F)=CC1(C2=CC=C(F)C=C2F)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CCC(C)OC1=CC=CC(CC2=NC=C(CC(=O)OC)C3=CC(OC)=C(OC)C=C23)=C1.CCCCCC.CCOC(C)=O.O=[Se]=O as the reactants and reagents.",
"input": "",
"output": " CCC(C)OC1=CC=CC(C(=O)C2=NC=C(CC(=O)OC)C3=CC(OC)=C(OC)C=C23)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1CCOC1.CC1=CC=C2OCC(=O)NC2=N1.[Al+3].[H-].[Li+] as the reactants and reagents.",
"input": "",
"output": " CC1=CC=C2OCCNC2=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC1(C2=CC=CC(NS(C)(=O)=O)=C2)C2CNCC21.CCN(CC)CC.CCN=C=NCCCN(C)C.CN(C)C=O.Cl.O.O=C(O)CCC1=CC=C(F)C=C1.ON1N=NC2=CC=CC=C21 , what product could potentially be produced?",
"input": "",
"output": "The product can be CC1(C2=CC=CC(NS(C)(=O)=O)=C2)C2CN(C(=O)CCC3=CC=C(F)C=C3)CC21.N .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC#N.CC1C[N+]2(F)CC[N+]1(Cl)CC2.CCOCC.COC(=O)C1=NN(C2=CC=CC=C2F)C(OC)=C1.Cl.F[B-](F)(F)F.O Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be COC(=O)C1=NN(C2=CC=CC=C2F)C(OC)=C1F .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C1=CC=C([PH](C2=CC=CC=C2)(C2=CC=CC=C2)[Pd]([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)[PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.C1COCCO1.CC(C)N1C(=O)NC2=CC(B(O)O)=CC=C21.FC1=CC=C2C(=CBr)C3=CC=CC=C3COC2=C1.O=C([O-])[O-].[Na+] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CC(C)N1C(=O)NC2=CC(C=C3C4=CC=CC=C4COC4=CC(F)=CC=C34)=CC=C21 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC1=CC=CC=C1.CCOCC.NC1=NC=CC=C1OCC1=CC=C(Cl)C=C1.S=C=NC1=CC=CC=C1 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: S=C(NC1=CC=CC=C1)NC1=NC=CC=C1OCC1=CC=C(Cl)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCS.CN(C)C=O.O=C(O)C(CCBr)C1=CC=CC=C1.[H-].[Na+].[NaH] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CCSCCC(C(=O)O)C1=CC=CC=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CCO.CCOC(=O)/C=C(\\C)C1=CC=C(C(F)(F)F)C=C1.Cl.O.[Cl-].[Na+].[OH-] ",
"input": "",
"output": " C/C(=C\\C(=O)O)C1=CC=C(C(F)(F)F)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1=NNC=N1.C=O.CC(=O)O.CO.COC1=CC(C)=NC(N)=N1 ",
"input": "",
"output": " COC1=CC(C)=NC(NCN2C=NC=N2)=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CCCCOC(C)=O.Cl.NC(N)=O.NC1=CC=C(Br)C=C1C(=O)O.O.O=C=NC1=CC=C(Cl)C=C1 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " O=C1NC2=CC=C(Br)C=C2C(=O)N1C1=CC=C(Cl)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with BrC1=CN=C2C3=CC=CC=C3NC3=NC=CC=C3N12.C1=CC=C([PH](C2=CC=CC=C2)(C2=CC=CC=C2)[Pd]([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)[PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.CC(C)(C)OC(=O)NC1(C2=CC=C(B3OC(C)(C)C(C)(C)O3)C=C2)CCC1.CC1=CC=CC=C1CCO.O.O=C([O-])O.[Na+] as the reactants and reagents.",
"input": "",
"output": " CC(C)(C)OC(=O)NC1(C2=CC=C(C3=CN=C4C5=CC=CC=C5NC5=NC=CC=C5N34)C=C2)CCC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C(=NC1CCCCC1)=NC1CCCCC1.C1CCOC1.CC(=O)O.CCN(CC)CC.CN(C)C1=CC=CC=N1.CO.O=C(N[C@@H](CO)C(=O)O)OCC1=CC=CC=C1.O=C(O)C1CNC1 Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be COC(=O)C1CN(C(=O)[C@H](CO)NC(=O)OCC2=CC=CC=C2)C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using Br[Mg]C1=CC=CS1.C1CCOC1.CN(C)C(C#N)C1CCC2(CC1)OCCO2.O.[Cl-].[NH4+] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CN(C)C(C1=CC=CS1)C1CCC2(CC1)OCCO2 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CCC(=N)NO.CCOC1=CC=C(C2=NC=C(C(=O)N(C3CC3)C3CCN(C#N)CC3)C=N2)C=N1 ",
"input": "",
"output": " CCOC1=CC=C(C2=NC=C(C(=O)N(C3CC3)C3CCN(C4=NC(CC)=NO4)CC3)C=N2)C=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1=CC=C(P(C2=CC=CC=C2)[C-]2C=CC=C2)C=C1.C1COCCO1.CC(C)(C)OC(=O)NC1C2CN(C(=O)C3=CC=C(I)C=C3)CC21.CC(OC1=CC(B2OC(C)(C)C(C)(C)O2)=CN=C1N)C1=C(Cl)C=CC(F)=C1Cl.CCOC(C)=O.COCCOC.Cl.ClCCl.Cl[Pd]Cl.O=C([O-])[O-].[Cs+].[Fe+2] ",
"input": "",
"output": " CC(OC1=CC(C2=CC=C(C(=O)N3CC4C(N)C4C3)C=C2)=CN=C1N)C1=C(Cl)C=CC(F)=C1Cl ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CCOCC.Cl.FC1=CC=C(CC2CCNCC2)C=C1.O=C(CCl)NC1=CC=C([N+](=O)[O-])C=C1 ",
"input": "",
"output": " O=C(CN1CCC(CC2=CC=C(F)C=C2)CC1)NC1=CC=C([N+](=O)[O-])C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. BrC1=CN=CC(OCC2=CC=CC=C2)=C1.N.O.O=S(=O)([O-])[O-].[Cu+2] ",
"input": "",
"output": " NC1=CN=CC(OCC2=CC=CC=C2)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CC#CCOC1=CC=C(S(=O)C(C(=O)NO)C2=CC=C(C3=CC=CS3)C=C2)C=C1.CC#CCOC1=CC=C(SC(C(=O)NO)C2=CC=C(C3=CC=CS3)C=C2)C=C1 as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CC#CCOC1=CC=C(S(=O)(=O)C(C(=O)NO)C2=CC=C(C3=CC=CS3)C=C2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if ClC1=CC(Cl)=NC=N1.I.OB(O)C1=CC(F)=C(F)C=C1F is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " FC1=CC(F)=C(C2=CC(I)=NC=N2)C=C1F ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1=CC=[NH+]C=C1.COC1=CC=CN=C1NC1=CC=CC=C1.Cl.[Cl-] ",
"input": "",
"output": " OC1=CC=CN=C1NC1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC#N.CC(C)(C)OC(=O)N1CCC[C@@H](OC2=CC=NC3=C2C2=CC(Br)=NC=C2N3COCC[Si](C)(C)C)C1.CN1C=C(B2OC(C)(C)C(C)(C)O2)C=N1.O=C([O-])[O-].[Na+] ",
"input": "",
"output": " CN1C=C(C2=CC3=C(C=N2)N(COCC[Si](C)(C)C)C2=NC=CC(O[C@@H]4CCCN(C(=O)OC(C)(C)C)C4)=C32)C=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CCN(CC)CC.CCN=C=NCCCN(C)C.Cl.ClCCl.NC1CC2(CCC2)OC2=C(F)C=C(F)C=C21.O=C(O)CCC1=CC=C2OCCOC2=C1.ON1N=NC2=CC=CC=C21 , what product could potentially be produced?",
"input": "",
"output": "The product can be O=C(CCC1=CC=C2OC=COC2=C1)NC1CC2(CCC2)OC2=CC=C(F)C=C21 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C1=CSC=N1.CC(C)(C)OC(=O)C1=NC=CS1.CCOC(=O)C1=CSC(NC(=O)C2=CSC(NC(=O)OC(C)(C)C)=N2)=N1.CN(C)C=O.O=C(O)C(F)(F)F is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CCOC(=O)C1=CSC(NC(=O)C2=CSC(NC(=O)C3=CSC(NC(=O)OC(C)(C)C)=N3)=N2)=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " O=C(NC1=CC=C(OC(F)(F)F)C=C1)C1=CN=C(N2CC[C@H](CO)C2)C(Br)=C1.OB(O)C1=NNC=C1 Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be O=C(NC1=CC=C(OC(F)(F)F)C=C1)C1=CN=C(N2CC[C@H](CO)C2)C(C2=CC=NN2)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with BrB(Br)Br.COC1=CC(C2=CC=CC(C(F)(F)F)=C2)=CC(C)=C1C(=O)N1CCC(N2CCCC2)CC1.ClCCl.O=C([O-])O.[Na+] as the reactants and reagents.",
"input": "",
"output": " CC1=CC(C2=CC=CC(C(F)(F)F)=C2)=CC(O)=C1C(=O)N1CCC(N2CCCC2)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CN(C)S(=O)(=O)Cl.COC1=CC=CC2=C1C(NC1=CC=C3C=C(N)C=CC3=N1)CC2 , what product could potentially be produced?",
"input": "",
"output": "The product can be COC1=CC=CC2=C1C(NC1=CC=C3C=C(NS(=O)(=O)N(C)C)C=CC3=N1)CC2 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C1=CC=CC=C1.CC1=NC2=C(OCC(=O)N2)C(N2CCOCC2)=N1.CCCC[N+](CCCC)(CCCC)CCCC.OCC1CO1.[Br-] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CC1=NC(N2CCOCC2)=C2OCC(=O)N(CC(O)CO)C2=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CO.COC(=O)C1=CC(OCC2=CC=CC=C2)=CC(O[C@@H](C)CO[Si](C)(C)C(C)(C)C)=C1.[Pd] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " COC(=O)C1=CC(O)=CC(O[C@@H](C)CO[Si](C)(C)C(C)(C)C)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1COCCO1.CC(C)(C)S(=O)NC1(C2=CC=C(C3=C(C4=CC=CC=C4)OC4=C(C=CN5C(=O)N(COCC[Si](C)(C)C)N=C45)C3=O)C=N2)CCC1.CO.Cl ",
"input": "",
"output": " NC1(C2=CC=C(C3=C(C4=CC=CC=C4)OC4=C(C=CN5C(=O)NN=C45)C3=O)C=N2)CCC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC(=O)C(=CC1=CC=CC([N+](=O)[O-])=C1)C(=O)OC(C)C.CCOCC.CN(C)C=O.NC1=CC(=O)N=N1 as the reactants and reagents.",
"input": "",
"output": " CC1=C(C(=O)OC(C)C)C(C2=CC=CC([N+](=O)[O-])=C2)N2NC(=O)C=C2N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)(C)OC(=O)CN1C(=O)[C@@H](NC(=O)C2(CC(CC(=O)NCCCO)C(=O)[O-])CCCC2)CCC2=CC=CC=C21.CCO.O.[Na+].[OH-] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be O=C(O)CN1C(=O)[C@@H](NC(=O)C2(CC(CC(=O)NCCCO)C(=O)O)CCCC2)CCC2=CC=CC=C21 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. C1CCOC1.CC(C)[Si](OS(=O)(=O)C(F)(F)F)(C(C)C)C(C)C.CCCN(CCC)C1CC2=CNC3=C2C(=C(Br)C=C3)C1.O=C([O-])O.[H-].[K+].[Na+] ",
"input": "",
"output": " CCCN(CCC)C1CC2=CN([Si](C(C)C)(C(C)C)C(C)C)C3=C2C(=C(Br)C=C3)C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. C1=CC=[NH+]C=C1.O=C(O)CCCCCCCCCCCO.O=[Cr](=O)([O-])Cl ",
"input": "",
"output": " O=CCCCCCCCCCCC(=O)O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) COC1=NN2C(CC3=CC=C4N=C(SC)SC4=C3)=CN=C2C=C1.ClCCl.O=C(OO)C1=CC=CC(Cl)=C1.O=S([O-])[O-].[Na+] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: COC1=NN2C(CC3=CC=C4N=C(S(C)=O)SC4=C3)=CN=C2C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. C#CC1=CC=CC=C1.C1C2CC3CC1CC(C2)C3.C=O.CC(=O)/C=C(/C)O.CC(=O)/C=C(\\C)O.CC(=O)O.Cl.O=C1C2=CC=CC=C2C(=O)N1O.O=O.[Co] ",
"input": "",
"output": " O=C(O)C12CC3CC(C#CC4=CC=CC=C4)(C1)CC(C(=O)O)(C3)C2 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C1CCOC1.Cl.O=C1OC(=O)C2=C1CCCC2.[BH4-].[Na+] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " O=C1OC(O)C2=C1CCCC2 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC1=CC=C(C)C(N)=C1C.O=C([O-])[O-].O=CCCl.[Na+] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CC1=CC=C(C)C(NCC=O)=C1C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC(=O)OC(C)=O.CC(=O)[O-].CCOCC.CO.N#CC1=CC=CC(N2CCC3=CC(OCC4=CC=CC=C4)=CC=C32)=C1.[H][H].[Na+].[Ni] .",
"input": "",
"output": " CC(=O)NCC1=CC=CC(N2CCC3=CC(OCC4=CC=CC=C4)=CC=C32)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.CO.COC(=O)C1=CC=C(C2=CC=C(NC3=NC4=CC=C(F)C=C4S3)C=C2)C=C1Cl.O.[Na+].[OH-] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " O=C(O)C1=CC=C(C2=CC=C(NC3=NC4=CC=C(F)C=C4S3)C=C2)C=C1Cl ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1CCOC1.CC(C)CO[Al](OCC(C)C)OCC(C)C.CC1=C(C(=O)O)OC2=CC=C(C#N)C=C12.CN(C)C=O.Cl.O=C(Cl)C(=O)Cl.[H-].[Li+].[Mn+4].[O-2] ",
"input": "",
"output": " CC1=C(C=O)OC2=CC=C(C#N)C=C12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1CCOC1.CO.COCCOC1=CC(N(C)S(=O)(=O)C2=CC=CC=N2)=C2NC(C3=N[C@@H](C(=O)OC)CS3)=CC2=C1.O.O=P(C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1.[BH4-].[Na+] ",
"input": "",
"output": " COCCOC1=CC(N(C)S(=O)(=O)C2=CC=CC=N2)=C2NC(C3=N[C@@H](CO)CS3)=CC2=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C1CCOC1.CC(C)NC(C)C.CN(C)P(=O)(N(C)C)N(C)C.CON(C)C(=O)C1=CC=NC=C1.O=C(O)C1=CSC=C1Br.[Li]CCCC as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: O=C(C1=CC=NC=C1)C1=C(C(=O)O)C(Br)=CS1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CCN(C(C)C)C(C)C.CCOC(=O)C1=C(N(C)CCO)OCC1=O.COCCOCCl.ClCCl.O , what product could potentially be produced?",
"input": "",
"output": "The product can be CCOC(=O)C1=C(N(C)CCOCOCCOC)OCC1=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C1=CC=C(P(C2=CC=CC=C2)[C-]2C=CC=C2)C=C1.C1CCOC1.C=O.CC(=O)[O-].CC1=C(F)C=C(C2=CC=CC(F)=C2)C=C1Br.CO.[Fe+2].[K+].[Pd+2] .",
"input": "",
"output": " COC(=O)C1=CC(C2=CC=CC(F)=C2)=CC(F)=C1C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if COC(=S)C1=CC(N)=C(C)S1.OB(O)C1=CC=C(Cl)C=C1 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " COC(=S)C1=CC(NC2=CC=C(Cl)C=C2)=C(C)S1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(O)C(C)CC(=O)C1=CC=CC=C1.NN.O=C([O-])[O-].OCCOCCO.[K+] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CCCCCC1=CC=C(O)C(C)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C1CCOC1.CC(C)C[C@H](NC(=O)OC(C)(C)C)C(=O)NC1(C#N)CC1.CCN=C=NCCCN(C)C.CN(C)C=O.Cl.ClCCl.O=C(O)C(F)(F)F.O=C(O)C1CCC2(CC1)OCCO2.ON1N=NC2=CC=CN=C21 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CC(C)C[C@H](NC(=O)C1CCC2(CC1)OCCO2)C(=O)NC1(C#N)CC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CN1N=C(C(=O)O)C=CC1=O.ClCCl.NC1=CNC2=NC=C(Br)C(F)=C12.O.O=C1OCCN1P(=O)(Cl)N1CCOC1=O.[Li+].[OH-] , what product could potentially be produced?",
"input": "",
"output": "The product can be CN1N=C(C(=O)NC2=CNC3=NC=C(Br)C(F)=C23)C=CC1=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses NC1=CC=CC(C(F)(F)F)=C1.O=C(Cl)C1=CC=C(F)C([N+](=O)[O-])=C1 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: O=C(NC1=CC=CC(C(F)(F)F)=C1)C1=CC=C(F)C([N+](=O)[O-])=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using BrCCBr.C1=COC(P(C2=CC=CO2)C2=CC=CO2)=C1.CC(C)(C)OC(=O)N1CC(I)C1.CN(C)C=O.COC1=C(C(C)=O)C=C(Cl)C(Cl)=C1I.C[Si](C)(C)Cl.O=C(/C=C/C1=CC=CC=C1)/C=C/C1=CC=CC=C1.[Pd].[Zn] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " COC1=C(C(C)=O)C=C(Cl)C(Cl)=C1C1CN(C(=O)OC(C)(C)C)C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CN(C)/C=C/C(=O)C1=NN(C2=CC=CC(OC(F)(F)F)=C2)C=CC1=O.NNC1=CC=C(S(N)(=O)=O)C=C1 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: NS(=O)(=O)C1=CC=C(N2N=CC=C2C2=NN(C3=CC=CC(OC(F)(F)F)=C3)C=CC2=O)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC(=O)O.CCO.COC(=O)CCC1=CC=CC=C1C1=CCN(C(=O)OC(C)(C)C)CC1.O=[Pt]=O as the reactants and reagents.",
"input": "",
"output": " COC(=O)CCC1=CC=CC=C1C1CCN(C(=O)OC(C)(C)C)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C1CCOC1.CCOCCl.CN(C)C=O.CN1N=C(CO)N=C1NCCCOC1=CC=CC(CN2CCCCC2)=C1.[H-].[Na+] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CCOCOCC1=NN(C)C(NCCCOC2=CC=CC(CN3CCCCC3)=C2)=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CC=C(P(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.CC(C)OC(=O)/N=N/C(=O)OC(C)C.CN(C)C=O.O.O=C(NC1=CC=NC=C1)C1=CC=CNC1=O.O=C1CCC2=C1C=CC=C2[N+](=O)[O-] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " O=C(NC1=CC=NC=C1)C1=CC=CN(C2CCC3=C2C=CC=C3[N+](=O)[O-])C1=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C1CCOC1.CCC(C(=O)O)C1=CC=C([N+](=O)[O-])C=C1.CO , what product could potentially be produced?",
"input": "",
"output": "The product can be CCC(CO)C1=CC=C([N+](=O)[O-])C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC1=CC=C(N=C=O)C=C1C.OC1=CC=C2C(=C1)CCN2CC1=CC=CC=C1 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC1=CC=C(NC(=O)OC2=CC=C3C(=C2)CCN3CC2=CC=CC=C2)C=C1C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C#CC1=CC=CC=C1.CC#N.Cl[Pd]Cl.FC(F)(F)C1=CN=CC(Cl)=C1.O.O=C([O-])[O-].[Cs+] .",
"input": "",
"output": " FC(F)(F)C1=CN=CC(C#CC2=CC=CC=C2)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CCOC(=O)CC1CCCN2C1=C(CC1=CC=C(Cl)C=C1)C1=C(SC)C=CC=C12.CO.ClCCl.O=C([O-])C1=CC=CC=C1C(=O)O[O-].[Mg+2] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CCOC(=O)CC1CCCN2C1=C(CC1=CC=C(Cl)C=C1)C1=C(S(C)=O)C=CC=C12 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CCC(CO)(CO)C(C)O.CCCC(C(=O)OCC)(C(=O)OCC)C(=O)C(F)(F)F as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CCCC(CO)(CO)C(O)C(F)(F)F .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C1CCC2OC2C1.CO.O=C(NC1=CC=C(OC2=CC=C(C(=O)N3CCNCC3)C=C2)N=C1)C1=CC=C(C(F)(F)F)C=C1 , what product could potentially be produced?",
"input": "",
"output": "The product can be O=C(NC1=CC=C(OC2=CC=C(C(=O)N3CCN([C@H]4CCCC[C@@H]4O)CC3)C=C2)N=C1)C1=CC=C(C(F)(F)F)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC(C)(C)OC(=O)NN=CC1=C(C(=O)O)N2C(=O)C(NC(=O)CC3=CC=CS3)[C@H]2SC1.COC1=CC=CC=C1.ClCCl.O=C(O)C(F)(F)F ",
"input": "",
"output": " NN=CC1=C(C(=O)O)N2C(=O)C(NC(=O)CC3=CC=CS3)[C@H]2SC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)(C)OC(=O)N1CCCC1CN.O=C(O)C1=CC=C(Cl)S1 Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CC(C)(C)OC(=O)N1CCCC1CNC(=O)C1=CC=C(Cl)S1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCOC1CCCCC1=O.CN(C)C(OC(C)(C)C)N(C)C Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CCOC1CCCC(=CN(C)C)C1=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCN(CC)CCCCl.CCO.CC[O-].Cl.O=C1NC(=O)C(CC2=CNC3=CC=CC=C23)N1.[Na+] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CCN(CC)CCCN1C(=O)NC(CC2=CNC3=CC=CC=C23)C1=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C1=CC2=C(C=C1C1CCNCC1)OCCO2.CCOC(C)=O.ClCCCOC1=CC=CC2=C1C=CN2.O=C(O)C(=O)O , what product could potentially be produced?",
"input": "",
"output": "The product can be C1=CC(OCCCN2CCC(C3=CC=C4OCCOC4=C3)CC2)=C2C=CNC2=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC1(NC(=O)OC(C)(C)C)CCCNC1.CCCCO.CCN(C(C)C)C(C)C.ClCCl.O=C(NC1=CNC2=NC=C(Br)C(F)=C12)C1=CC=CN=C1.O=C(O)C(F)(F)F as the reactants and reagents.",
"input": "",
"output": " CC1(N)CCCN(C2=C(Br)C=NC3=C2C(NC(=O)C2=CC=CN=C2)=CN3)C1.Cl ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. Br.COC1=CC=CC(C2CCC(=O)N2CCN2CCOCC2)=C1.O=C([O-])O.[Na+] ",
"input": "",
"output": " O=C1CCC(C2=CC=CC(O)=C2)N1CCN1CCOCC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CCO.COC(=O)OC1=CC([N+](=O)[O-])=C(F)C=C1C.O=[Pt]=O as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: COC(=O)OC1=CC(N)=C(F)C=C1C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " BrC1=CN=CN=C1.CC(C)[C@@H](N)C(=O)O.CN(C)CCO.Cl.O.O=C(O)C(F)(F)F.O=P([O-])([O-])[O-].[Cu]I.[K+] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CC(C)[C@@H](NC1=CN=CN=C1)C(=O)O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. C1CCOC1.COCCNS(C)(=O)=O.ClC1=NC(N2CCOCC2)=C2SC(CBr)=CC2=N1.[H-].[Na+] ",
"input": "",
"output": " COCCN(CC1=CC2=NC(Cl)=NC(N3CCOCC3)=C2S1)S(C)(=O)=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCO.N#CCCCCCCCCNS(=O)(=O)C1=CC=CC(Cl)=C1.O.[Na+].[OH-] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " O=C(O)CCCCCCCCNS(=O)(=O)C1=CC=CC(Cl)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C=CC(=O)OC.CC(=O)[O-].CC1(C)CCC(C)(C)C2=CC(C(=O)C3=CC=CC(I)=C3)=CC=C21.CCCC[N+](CCCC)(CCCC)CCCC.CN(C)C=O.O.O=C([O-])[O-].[Cl-].[K+].[Pd+2] as the reactants and reagents.",
"input": "",
"output": " COC(=O)C=CC1=CC=CC(C(=O)C2=CC=C3C(=C2)C(C)(C)CCC3(C)C)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC1=CC=CC=C1N1N=NC2=C(O[C@@H](COCCO[Si](C3=CC=CC=C3)(C3=CC=CC=C3)C(C)(C)C)C(=O)NC3=CC=C(Cl)C=N3)N=CN=C21.CO.Cl ",
"input": "",
"output": " CC1=CC=CC=C1N1N=NC2=C(O[C@@H](COCCO)C(=O)NC3=CC=C(Cl)C=N3)N=CN=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CCOC(=O)C(OC1=CC=C(C2=CC=C(Cl)C=C2)C=C1)(C(F)(F)F)C(F)(F)F.CCOC(=O)C(OC1=CC=C(C2=CC=CC=C2)C=C1)(C(F)(F)F)C(F)(F)F.CCOC(=O)C(OC1=CC=C(Cl)C=C1)(C(F)(F)F)C(F)(F)F.CCOC(=O)C(OC1=CC=C(F)C=C1)(C(F)(F)F)C(F)(F)F.CCOC(=O)C(OC1=CC=CC2=CC=CC=C12)(C(F)(F)F)C(F)(F)F.[K+].[OH-] ",
"input": "",
"output": " O=C(O)C(OC1=CC=C(C2=CC=C(Cl)C=C2)C=C1)(C(F)(F)F)C(F)(F)F.O=C(O)C(OC1=CC=C(C2=CC=CC=C2)C=C1)(C(F)(F)F)C(F)(F)F.O=C(O)C(OC1=CC=C(F)C=C1)(C(F)(F)F)C(F)(F)F.O=C(O)C(OC1=CC=CC2=CC=CC=C12)(C(F)(F)F)C(F)(F)F ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if COC(=O)CC1=CC=C(OC)C(C2=CC=C(C(F)(F)F)C=C2C=O)=C1.Cl.NC1CC2=CC=CC=C2C1 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " COC(=O)CC1=CC=C(OC)C(C2=CC=C(C(F)(F)F)C=C2CNC2CC3=CC=CC=C3C2)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC1=NC(N(CC2=CC=CC=C2)CC2=CC=CC=C2)=C([N+](=O)[O-])C(NCC2(O)CCCCC2)=C1C.CCOC(C)=O.[Pt] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC1=NC(N(CC2=CC=CC=C2)CC2=CC=CC=C2)=C(N)C(NCC2(O)CCCCC2)=C1C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC(C)(C)OC(=O)NCC(=O)O.CCN(CC)CC.CCN=C=NCCCN(C)C.CN(C)C=O.CO.Cl.ClCCl.NC1=NC=C(C2=NC(N3CCOCC3)=C3N=C(N4CCNCC4)N(CC4CC4)C3=N2)C=N1.O.ON1N=NC2=CC=CC=C21 as the reactants and reagents.",
"input": "",
"output": " NCC(=O)N1CCN(C2=NC3=C(N4CCOCC4)N=C(C4=CN=C(N)N=C4)N=C3N2CC2CC2)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CCON=C(C(=O)N[C@@H]1C(=O)N(S(=O)(=O)[O-])[C@@H]1C(=O)OC)C1=CSC(NC(=O)CCl)=N1.CSC(N)=S.O.[Na+].[NaH] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CCON=C(C(=O)N[C@@H]1C(=O)N(S(=O)(=O)[O-])[C@@H]1C(=O)OC)C1=CSC(N)=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CCCCCCCC=O.O=CC1=CC=CC=C1 .",
"input": "",
"output": " CCCCCCC(C=O)=CC1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC1=CC=C2NC(=O)CCC2=C1.CCOS(=O)(=O)OCC.CC[N+](CC)(CC)CC1=CC=CC=C1.ClCCl.O.[Cl-].[Na+].[OH-] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CCN1C(=O)CCC2=CC(C)=CC=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC1(C)OC(=O)NC2=C(OCCCCSC3=CC=CC=C3)C=CC=C21.OO ",
"input": "",
"output": " CC1(C)OC(=O)NC2=C(OCCCCS(=O)C3=CC=CC=C3)C=CC=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C1=CC=C(P(C2=CC=CC=C2)[C-]2C=CC=C2)C=C1.C1CCOC1.CC1(C)OB(C2=CC(Cl)=CC(C#N)=C2)OC1(C)C.CC1=NC2(N=C1N)C1=CC(Br)=CC=C1CC21CC1.Cl[Pd]Cl.O=C([O-])[O-].[Fe+2].[K+] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CC1=NC2(N=C1N)C1=CC(C3=CC(Cl)=CC(C#N)=C3)=CC=C1CC21CC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1COCCO1.CC(C)(C)OC(=O)CNCCO.O.O=C(Cl)OCC1=CC=CC=C1.O=C([O-])[O-].[K+] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CC(C)(C)OC(=O)CN(CCO)C(=O)OCC1=CC=CC=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. C1CCOC1.CCCCC[C@H](C=CC1=CC=CC=C1C=C[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](CCCC(=O)OC)O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C.CCCC[N+](CCCC)(CCCC)CCCC.[F-] ",
"input": "",
"output": " CCCCC[C@@H](O)C=CC1=CC=CC=C1C=C[C@@H](O)[C@@H](O)CCCC(=O)OC ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CCOC(=O)C1(C2=CC=C(C3=CC=C(C4=C(C=O)C(C)=NO4)C=C3)C=C2)CC1.FC(F)(F)C1=CC=CC(C2=CN=CC(Br)=C2)=C1 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CCOC(=O)C1(C2=CC=C(C3=CC=C(C4=C(C(O)C5=CN=CC(C6=CC=CC(C(F)(F)F)=C6)=C5)C(C)=NO4)C=C3)C=C2)CC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. N#CC1=C(I)C(CO)=C(I)C(C(=O)O)=C1I.O.[Na+].[OH-] ",
"input": "",
"output": " NC(=O)C1=C(I)C(CO)=C(I)C(C(=O)O)=C1I ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C=CC(=O)OC.CC(C)(C)OC(=O)N1CCC2(CC1)CC(=O)C1=CC=C(Br)C=C1O2.COC(=O)/C=C/C1=CC=C2OC3(CCNCC3)CC(=O)C2=C1 as the reactants and reagents.",
"input": "",
"output": " COC(=O)/C=C/C1=CC=C2C(=O)CC3(CCN(C(=O)OC(C)(C)C)CC3)OC2=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CS(=O)(=O)CC1=CC=CC(NC2=NC=NC(C3=CC=C(F)C=C3F)=N2)=C1.OCC1=CC=CC(F)=C1F Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CS(=O)(=O)CC1=CC=CC(NC2=NC=NC(C3=CC=C(F)C=C3OCC3=CC=CC(F)=C3F)=N2)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC(=O)OC(C)=O.CN(C)C=NS(=O)(=O)C1=CC2=C(C=CC=[N+]2[O-])S1 ",
"input": "",
"output": " NS(=O)(=O)C1=CC2=C(C=CC(=O)N2)S1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C1=CC=C([PH](C2=CC=CC=C2)(C2=CC=CC=C2)[Pd]([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)[PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.C1COCCO1.CCOC(=O)C1=C(C2=CC=C(B3OC(C)(C)C(C)(C)O3)C=C2[N+](=O)[O-])N([C@H]2CCOC2)N=C1.CCOC1=CC(C)=C(Br)C(C)=N1.O.O=C([O-])[O-].[Cs+] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CCOC(=O)C1=C(C2=CC=C(C3=C(C)C=C(OCC)N=C3C)C=C2[N+](=O)[O-])N([C@H]2CCOC2)N=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CCOC(=O)CSC1=C(C(=O)OCC)NC2=CC=CC=C12.ClCCl.O=C(OO)C1=CC=CC(Cl)=C1 , what product could potentially be produced?",
"input": "",
"output": "The product can be CCOC(=O)CS(=O)C1=C(C(=O)OCC)NC2=CC=CC=C12 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CS(N)(=O)=O.Cl.ClC[C@@H]1CO1.O.[Na+].[OH-] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CS(=O)(=O)NC[C@H]1CO1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using BrCC1CCCCO1.CCOC(C)=O.CN(C)C=O.COC1=CC2=C(C=C1O)NC1=CC(C3=CC=C([N+](=O)[O-])C(OC)=C3)=CC=C1C(=O)N2.O=C([O-])[O-].[K+] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " COC1=CC2=C(C=C1OCC1CCCCO1)NC1=CC(C3=CC=C([N+](=O)[O-])C(OC)=C3)=CC=C1C(=O)N2 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C1CCOC1.CCO.O=C(CCCCC(=O)OC1=C(C2=CC=C(OCC3=CC=CC=C3)C(OCC3=CC=CC=C3)=C2)OC2=CC=CC=C2C1=O)OCC1=CC=CC=C1.[OH-].[Pd+2] , what product could potentially be produced?",
"input": "",
"output": "The product can be O=C1C=C(C2=CC=C(O)C(O)=C2)OC2=CC=CC=C12 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using NC(=O)C1=CC=CC2=C1OC1=CC=CC=C1C2=C1CC2CCC(C1)N2C(=O)C(F)(F)F.O=C(N1C2CCC1CC(=C1C3=CC=CC=C3OC3=C(O)C=CC=C13)C2)C(F)(F)F as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " NC(=O)C1=CC=CC2=C1OC1=CC=CC=C1C2=C1CC2CCC(C1)N2.O=C(O)C(F)(F)F ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CO.COC1=CC(C(C)C)=C(OC2=CN=C(N)N=C2N)C=C1C#N.NCCN as the reactants and reagents.",
"input": "",
"output": " COC1=CC(C(C)C)=C(OC2=CN=C(N)N=C2N)C=C1C1=NCCN1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C1=NN=NN1.C1CCOC1.CCN(CC)P1OCC2=CC=CC=C2CO1.CC[C@](CO)(CCC1=CC=C(OCCCCC2=CC=CC=C2)C(OC)=C1)NC(=O)OC(C)(C)C.OO .",
"input": "",
"output": " COC1=CC(CC[C@](C)(COP2(=O)OCC3=CC=CC=C3CO2)NC(=O)OC(C)(C)C)=CC=C1OCCCCC1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C1CCOC1.C1COCCO1.CO.ClCCl.N.O=C1CCCC2=C1C(CCC(=O)N1CCNCC1)=CN2.[Al+3].[H-].[Li+] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: C1=C(CCCN2CCNCC2)C2=C(CCCC2)N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(=O)O.CC(=O)O[BH-](OC(C)=O)OC(C)=O.ClCCl.NC1=CC=CC=C1.O=CC1=CC=CC(C(=O)N2CCS[C@H]2C(=O)O[C@@H](CC2=C(Cl)C=[N+]([O-])C=C2Cl)C2=CC=C(OC(F)F)C(OCC3CC3)=C2)=C1.[Na+] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be O=C(O[C@@H](CC1=C(Cl)C=[N+]([O-])C=C1Cl)C1=CC=C(OC(F)F)C(OCC2CC2)=C1)[C@@H]1SCCN1C(=O)C1=CC=CC(CNC2=CC=CC=C2)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC(=O)O.CCO.COC1=CC(C=O)=C([N+](=O)[O-])C=C1OC.COCCN ",
"input": "",
"output": " COCCN=CC1=CC(OC)=C(OC)C=C1[N+](=O)[O-] ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC(=O)O[BH-](OC(C)=O)OC(C)=O.CC(C)(C)[Si](C)(C)O[C@@H]1C[C@H]2CNCC(C(C3=CC=CC=C3)C3=CC=CC=C3)N2C1.COC1=CC=C(N2N=NN=C2C(F)(F)F)C=C1C=O.ClCCl.[Na+] , what product could potentially be produced?",
"input": "",
"output": "The product can be COC1=CC=C(N2N=NN=C2C(F)(F)F)C=C1CN1C[C@@H]2C[C@@H](O[Si](C)(C)C(C)(C)C)CN2[C@H](C(C2=CC=CC=C2)C2=CC=CC=C2)C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CON=C1C[C@@H](C(=O)O)N(C(=O)OC(C)(C)C)C1.N[C@H]1[C@@H]2CC[C@@H](C2)[C@H]1CO.O=S(=O)(Cl)C1=CC=C(C2=CC=CC=C2)C=C1 ",
"input": "",
"output": " CON=C1C[C@@H](C(=O)N[C@H]2[C@@H]3CC[C@@H](C3)[C@H]2CO)N(S(=O)(=O)C2=CC=C(C3=CC=CC=C3)C=C2)C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C(=NC1CCCCC1)=NC1CCCCC1.C[C@@H](NC(=O)OC(C)(C)C)C(=O)O.NC(CO)CO.ON1N=NC2=CC=CC=C21 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: C[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H](CO)C(=O)O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CC(=O)O.CCC1=CC=CC(OC)=C1[N+](=O)[O-].O=S(=O)(O)O.O=[N+]([O-])O as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CCC1=C([N+](=O)[O-])C=CC(OC)=C1[N+](=O)[O-] .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CO.COCCOCO[C@@H](CC#CCOCC1=CC=CC=C1)COC1=CC=C(F)C=C1.[Pd] ",
"input": "",
"output": " COCCOCO[C@@H](CCCCO)COC1=CC=C(F)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CN(C)S(=O)(=O)C1=CC(N2CCOCC2)=CC=C1NC1=NC(Cl)=NC=C1Cl.COCCN1CCC2=CC=C(N)C=C2CC1 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: COCCN1CCC2=CC=C(NC3=NC=C(Cl)C(NC4=CC=C(N5CCOCC5)C=C4S(=O)(=O)N(C)C)=N3)C=C2CC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses BrBr.CC(=O)O.CC(=O)[O-].CC1=CC(OCC2=CC=CC(Cl)=C2)=CC(=O)N1CC1=CC=CC=C1.[Na+] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CC1=CC(OCC2=CC=CC(Cl)=C2)=C(Br)C(=O)N1CC1=CC=CC=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC1=CC(O)=NC(S)=N1.CCC1=CC=NC(CC)=C1CBr.CN(C)C=O.O=C([O-])[O-].[K+] ",
"input": "",
"output": " CCC1=CC=NC(CC)=C1CSC1=NC(C)=CC(O)=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CC1=CC=CC(C2(O)CNC(=O)C=C2C2=CC=NC=C2)=C1.ClC(Cl)Cl.O=S(=O)(O)O as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CC1=CC=CC(C2=CNC(=O)C=C2C2=CC=NC=C2)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CC=CC=C1.CCOP(=O)(CCCCC1=CC=CC=C1)OCC.ClP(Cl)(Cl)(Cl)Cl Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CCOP(=O)(Cl)CCCCC1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC#N.CC(C)S(=O)(=O)C1=CC=C(C2=CN=C(N(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C)C(C3=CN(C4=CC=CC=C4)N=N3)=N2)C=C1.ClCCl.O=C(O)C(F)(F)F is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC(C)S(=O)(=O)C1=CC=C(C2=CN=C(N)C(C3=CN(C4=CC=CC=C4)N=N3)=N2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC1=CC([N+](=O)[O-])=CC(N)=C1N.Cl.O=C(O)C(=O)O Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CC1=CC([N+](=O)[O-])=CC2=NC(=O)C(=O)N=C12 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CN(C)C=O.IC1=CC=CC(N2N=NC(CN3CCCN4C(C5=CC=NC=C5)=NN=C34)=N2)=C1.[C-]#N.[Zn+2] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be N#CC1=CC=CC(N2N=NC(CN3CCCN4C(C5=CC=NC=C5)=NN=C34)=N2)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC(O)CN(CC(C)O)C1=C(F)C=C(C#N)C=C1F.CCO.[Na+].[OH-] ",
"input": "",
"output": " CC(O)CN(CC(C)O)C1=C(F)C=C(C(=O)O)C=C1F ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. COC1=CC=C2C(COC3=CC=CC4=C3C=C(C(=O)O)N4)=COC2=C1.C[C@H]1CN([C@@H](C)CN2CCC(N)CC2)CC[C@@H]1O.Cl ",
"input": "",
"output": " COC1=CC=C2C(COC3=CC=CC4=C3C=C(C(=O)NC3CCN(C[C@H](C)N5CC[C@H](O)[C@@H](C)C5)CC3)N4)=COC2=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C.CCOC(C)=O.CN1C(C2=CC=C(OCCCN3CCCCC3)C=C2)=NC2=CN=C(Cl)C=C2C1=O.[H][H].[Pd] , what product could potentially be produced?",
"input": "",
"output": "The product can be CN1C(C2=CC=C(OCCCN3CCCCC3)C=C2)=NC2=CN=CC=C2C1=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC(C)=O.COC1=CC=C(COC(=O)C2=C(CCl)CS[C@@H]3[C@H](NC(=O)CC4=CC=CC=C4)C(=O)N23)C=C1.NC(=O)C12CCN(CC1)CC2.[I-].[Na+] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " COC1=CC=C(COC(=O)C2=C(C[N+]34CCC(C(N)=O)(CC3)CC4)CS[C@@H]3[C@H](NC(=O)CC4=CC=CC=C4)C(=O)N23)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC1=CC(N2C=CC=CC2=O)=CC=C1N.O=C(Cl)OC1=CC=C([N+](=O)[O-])C=C1 Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CC1=CC(N2C=CC=CC2=O)=CC=C1NC(=O)OC1=CC=C([N+](=O)[O-])C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CCOC1=CC=C(N)C([N+](=O)[O-])=C1.O=C(O)C1=CNC=C1 ",
"input": "",
"output": " CCOC1=CC=C(NC(=O)C2=CNC=C2)C([N+](=O)[O-])=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CCCCCC.CCCCCCC(OC1=CC=C(C2=CCCCCC2)C=C1)C(=O)OCC.CCO.[Na+].[OH-] , what product could potentially be produced?",
"input": "",
"output": "The product can be CCCCCCC(OC1=CC=C(C2=CCCCCC2)C=C1)C(=O)O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(=O)OCC1=CC=C(C)C(C2=CC=CC=N2)=N1.CCO.Cl.[Na+].[OH-] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CC1=CC=C(CO)N=C1C1=CC=CC=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CCN1CCN(C(=O)CCl)CC1.COC1=CC=C(C2CCC3=CC(OC(=O)C(C)(C)C)=CC=C3C2)C(NCCCC(=O)C2=CC=C(O)C=C2)=C1 ",
"input": "",
"output": " CCN1CCN(CCOC2=CC=C(CCCCNC3=CC(OC)=CC=C3C3CCC4=CC(O)=CC=C4C3)C=C2)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CCC[N+](CCC)(CCC)CCC.C[N+]1([O-])CCOCC1.ClCCl.O=C1COC2=C(F)C=C(CO)C=C2N1.O=[Ru](=O)(=O)[O-] as the reactants and reagents.",
"input": "",
"output": " O=CC1=CC(F)=C2OCC(=O)NC2=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCCCCCCCCCCCCCCCCCOC1=C(OCCCCCCCCCCCCCCCCCC)C(OCCCCCCCCCCCCCCCCCC)=CC(COC2=C(OCC3=CC(OCCCCCCCCCCCCCCCCCC)=C(OCCCCCCCCCCCCCCCCCC)C(OCCCCCCCCCCCCCCCCCC)=C3)C(OCC3=CC(OCCCCCCCCCCCCCCCCCC)=C(OCCCCCCCCCCCCCCCCCC)C(OCCCCCCCCCCCCCCCCCC)=C3)=CC(C(=O)OC)=C2)=C1.COC1CCCC1.Cl.[Al+3].[H-].[Li+] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CCCCCCCCCCCCCCCCCCOC1=C(OCCCCCCCCCCCCCCCCCC)C(OCCCCCCCCCCCCCCCCCC)=CC(COC2=C(OCC3=CC(OCCCCCCCCCCCCCCCCCC)=C(OCCCCCCCCCCCCCCCCCC)C(OCCCCCCCCCCCCCCCCCC)=C3)C(OCC3=CC(OCCCCCCCCCCCCCCCCCC)=C(OCCCCCCCCCCCCCCCCCC)C(OCCCCCCCCCCCCCCCCCC)=C3)=CC(CO)=C2)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CCN=C=NCCCN(C)C.CN(C)C=O.COC1=CC=C(C2=C(C3=CC=C(OC)C=C3)SC(CN)=N2)C=C1.Cl.ClCCl.O.O=C(O)CC1=CC=CN=C1.O=C([O-])O.[Na+] as the reactants and reagents.",
"input": "",
"output": " COC1=CC=C(C2=C(C3=CC=C(OC)C=C3)SC(CNC(=O)CC3=CC=CN=C3)=N2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CN(C)C=O.COCCOCCOC1=CC2=C(C=C1OC)C(=O)NC=N2.O=S(Cl)Cl as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " COCCOCCOC1=CC2=NC=NC(Cl)=C2C=C1OC ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CC=NC=C1.C1CCOC1.COC1=CC(OC2CCN(C(=O)OC(C)(C)C)CC2)=CC=C1C(=O)O.O=S(Cl)Cl Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " COC1=CC(OC2CCN(C(=O)OC(C)(C)C)CC2)=CC=C1C(=O)Cl ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)OC(=O)C1=CC(N=C=O)=C(F)C=C1Cl.CCOC(=O)/C(CC)=C(/C)N.CN(C)C=O Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CCOC(=O)C(CC)=C(C)NC(=O)NC1=CC(C(=O)OC(C)C)=C(Cl)C=C1F .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CC1=NC=C([N+](=O)[O-])N1CCBr.CCS(=O)O.CS(C)=O.[NaH] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CCS(=O)(=O)CCN1C([N+](=O)[O-])=CN=C1C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C1CCOC1.CC1=CC=C(C(C)C)C=C1OS(=O)(=O)C(F)(F)F.CC1=CC=CC(C)=C1C1=NC2=C(CNCC2)C(N2C[C@H](C)N(C(=O)OC(C)(C)C)C[C@H]2C)=N1.O=C([O-])[O-].[Cs+] , what product could potentially be produced?",
"input": "",
"output": "The product can be CC1=CC=C(C(C)C)C=C1N1CCC2=NC(C3=C(C)C=CC=C3C)=NC(N3C[C@H](C)N(C(=O)OC(C)(C)C)C[C@H]3C)=C2C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC(C)O.CCO.CO.Cl.ClCCl.O.O=S(=O)(C1=CC=CC=C1)N1N=CC2=C(C3=NN=C(CCl)O3)C=C(C3=CC=CC4=C3C=CN4)C=C21.O=S([O-])C1=CC=CC=C1.[Na+].[OH-] ",
"input": "",
"output": " O=S(=O)(CC1=NN=C(C2=CC(C3=CC=CC4=C3C=CN4)=CC3=C2C=NN3)O1)C1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C=C(C(=O)OC(C1=CC=CC=C1)C1=CC=CC=C1)C1=C(F)C=C2C(=O)C(C(=O)OCC)=CN(C3CC3)C2=C1OC.CCOC(C)=O.CN(C)C=O.C[S+](C)(C)=O.Cl.O.[H-].[I-].[Na+] ",
"input": "",
"output": " CCOC(=O)C1=CN(C2CC2)C2=C(OC)C(C3(C(=O)OC(C4=CC=CC=C4)C4=CC=CC=C4)CC3)=C(F)C=C2C1=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CCO.CCOCC.CN(C[C@H]([C@@H](O)C1CCCCC1)N1C(=O)C2=CC=CC=C2C1=O)C(=O)OC(C)(C)C.NN.O is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CN(C[C@@H](N)[C@@H](O)C1CCCCC1)C(=O)OC(C)(C)C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CCOCC.FC1=CC=CC=C1CCl.II.O=C1CCCCCC1.[Cl-].[MgH2].[NH4+] ",
"input": "",
"output": " OC1(CC2=CC=CC=C2F)CCCCCC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CCOCC.CO.C[Si](C)(C)C=[N+]=[N-].O=C(O)[C@@H]1C[C@H](OCC(F)F)CN1C(=O)OCC1=CC=CC=C1 as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " COC(=O)[C@@H]1C[C@H](OCC(F)F)CN1C(=O)OCC1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. COC(=O)C1=CC=CN=C1NC(=O)C(C)CSC(C)=O.COC(=O)C1=CN=CC=C1NC(=O)C(C)CSC(C)=O ",
"input": "",
"output": " COC(=O)C1=CN=CC=C1NC(=O)C(C)CS ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. ClC1=CC=C([Mg]Br)C=C1.O=CC1=CC=C(F)C=C1C(F)(F)F.OC(C1=CC=C(Cl)C=C1)C1=CC=C(Cl)C=C1Cl ",
"input": "",
"output": " OC(C1=CC=C(Cl)C=C1)C1=CC=C(F)C=C1C(F)(F)F ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CCOC(C)=O.Cl.O.O=C([O-])NC1CCN(CCCOCCC2=CC=C3SC=CC3=C2)C1.[Na+].[OH-] ",
"input": "",
"output": " NC1CCN(CCCOCCC2=CC=C3SC=CC3=C2)C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CO.CSC1=CC=C(C(=O)CCC(C)=O)C=C1F.O.O=S([O-])OO.[K+] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CC(=O)CCC(=O)C1=CC=C(S(C)(=O)=O)C(F)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1CCOC1.CC(C)NC(C)C.CCOC(C)=O.CN1CCCC1=O.O=C1CC2CC(F)(F)C(C1)N2CC1=CC=CC=C1.[Li]CCCC ",
"input": "",
"output": " CCOC(=O)CC1(O)CC2CC(F)(F)C(C1)N2CC1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.CCCC[N+](CCCC)(CCCC)CCCC.C[Si](C)(C)C(F)(F)F.Cl.O=CC1=CC=C(C2=COC=C2)C=C1.[F-] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be OC(C1=CC=C(C2=COC=C2)C=C1)C(F)(F)F .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C1CN2CCN1CC2.CN(C(=O)Cl)C1=CC=CC=C1.CN(C)C=O.O.O=C(NC1=CC=C(O)N=C1)C1=CC=CC=C1 as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CN(C(=O)OC1=CC=C(NC(=O)C2=CC=CC=C2)C=N1)C1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CSC1C(=O)NC2=CC=C(C(F)(F)F)C=C21.ClC(Cl)(Cl)Cl.O=C1CCC(=O)N1Cl as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CSC1(Cl)C(=O)NC2=CC=C(C(F)(F)F)C=C21 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CCN(C(C)C)C(C)C.CN(C)C=O.COC(=O)C1=CC=C2N=C(C3=CC=CC=C3)C(Br)=NC2=C1.FC(F)(F)C1=CC=C(C2CCNCC2)C=C1 as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " COC(=O)C1=CC=C2N=C(C3=CC=CC=C3)C(N3CCC(C4=CC=C(C(F)(F)F)C=C4)CC3)=NC2=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CCOCC.COC1=CC=C(CN(C(=O)CCC(=O)OC(C)(C)C)C2=CC(OC)=C(C(=O)NCC3=CC=CC(C4=CC=CC=C4)=C3)C=N2)C(OC)=C1.O=C(O)C(F)(F)F as the reactants and reagents.",
"input": "",
"output": " O=C(O)CCC(=O)NC1=CC(O)=C(C(=O)NCC2=CC=CC(C3=CC=CC=C3)=C2)C=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CCOC(=O)C1=CC=CC=C1COC1=CC=C(C(C)(C)C(=O)OCC)C=C1.[K+].[OH-] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CC(C)(C(=O)O)C1=CC=C(OCC2=CC=CC=C2C(=O)O)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. COC(=O)CCCCCCCCO[C@H]1O[C@H](CO)[C@@H](O)[C@H](OC(C)=O)[C@H]1O[C@H]1O[C@H](COC(C)=O)[C@@H](OCC2=CC=CC=C2)[C@H](OCC2=CC=CC=C2)[C@H]1OCC1=CC=CC=C1.CS(=O)(=O)[O-] ",
"input": "",
"output": " COC(=O)CCCCCCCCO[C@H]1O[C@H](COS(C)(=O)=O)[C@@H](O)[C@H](OC(C)=O)[C@H]1O[C@H]1O[C@H](COC(C)=O)[C@@H](OCC2=CC=CC=C2)[C@H](OCC2=CC=CC=C2)[C@H]1OCC1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CC(=O)O.CCO.COC1=CC=C2C=C(C=O)C=CC2=C1.O.[C-]#N.[Na+] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " COC1=CC=C2C(C#N)=C(CO)C=CC2=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.CC(C)O.CCOC1=CC(Br)=CC=C1OC.O.O=CC1=CC=C2OC=CC2=C1.[Li]CCCC Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CCOC1=CC(C(O)C2=CC=C3OC=CC3=C2)=CC=C1OC .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: COC1=CC=CC=C1COCCCOC1=CC=C(C2CCN(C(=O)OCC3=CC=CC=C3)CC2O)C=C1.COCCCOC1=CC(CBr)=CC=C1Br , what product could potentially be produced?",
"input": "",
"output": "The product can be COCCCOC1=CC(COC2CN(C(=O)OCC3=CC=CC=C3)CCC2C2=CC=C(OCCCOCC3=CC=CC=C3OC)C=C2)=CC=C1Br .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C=CC(C)(C(=O)O)C(C)(C)O[Si](C)(C)C(C)(C)C.CC#N.CC(=O)O[C@H](C)C1=CC=C2C=CC(Br)=CC2=N1.CC(=O)[O-].CC1=CC=CC=C1P(C1=CC=CC=C1C)C1=CC=CC=C1C.CCN(CC)CC.[Pd+2] .",
"input": "",
"output": " CC(=O)O[C@H](C)C1=CC=C2C=CC(/C=C/C(C)(C(=O)O)C(C)(C)O[Si](C)(C)C(C)(C)C)=CC2=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CCC1=NC2=CC3=C(C=C2O1)CCNCC3.CN1C(SCCCCl)=NN=C1C1=CC=C(F)C(F)=C1 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CCC1=NC2=CC3=C(C=C2O1)CCN(CCCSC1=NN=C(C2=CC=C(F)C(F)=C2)N1C)CC3.Cl .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1=CC=C(P(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.C1CCOC1.CCOC(=O)/N=N/C(=O)OCC.CCOCC.O=C1C2=CC=CC=C2C(=O)N1O.OCC1=CC=NC2=CC=CC=C12 ",
"input": "",
"output": " O=C1C2=CC=CC=C2C(=O)N1OCC1=CC=NC2=CC=CC=C12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1CCOC1.COC1=CC=C(CC2=CC([C@]34OC[C@](C=O)(O3)[C@@H](OCC3=CC=CC=C3)[C@H](OCC3=CC=CC=C3)[C@H]4OCC3=CC=CC=C3)=CC=C2Cl)C(F)=C1F.C[Mg]Br ",
"input": "",
"output": " COC1=CC=C(CC2=CC([C@]34OC[C@](C(C)O)(O3)[C@@H](OCC3=CC=CC=C3)[C@H](OCC3=CC=CC=C3)[C@H]4OCC3=CC=CC=C3)=CC=C2Cl)C(F)=C1F ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CC1=NC(C(C)(N)CS(C)(=O)=O)=NO1.O=C(O)C1=CC(OCC(F)(F)F)=C(C2(O)CCC2)C=N1 as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CC1=NC(C(C)(CS(C)(=O)=O)NC(=O)C2=CC(OCC(F)(F)F)=C(C3(O)CCC3)C=N2)=NO1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CN(C)C1=CC=CC2=C(S(N)(=O)=O)C=CC=C12.CN(C)C=O.O=[N+]([O-])C1=CC=C(Cl)N=C1.[H-].[H][H].[Na+] as the reactants and reagents.",
"input": "",
"output": " CN(C)C1=CC=CC2=C(S(=O)(=O)NC3=CC=C([N+](=O)[O-])C=N3)C=CC=C12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CC#N.CC(=O)O.CC1=C(C(=O)NC2=CC=C(OC3=CC=NC(C(N)=O)=C3)C(F)=C2F)C(=O)N(C2=CC=CC=C2)N1C.CCOC(C)=O.IC1=CC=CC=C1.O as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CC1=C(C(=O)NC2=CC=C(OC3=CC=NC(N)=C3)C(F)=C2F)C(=O)N(C2=CC=CC=C2)N1C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC#N.CCCCS(=O)(=O)N[C@@H](CC1=CC=C(N)C=C1)C(=O)OC(C)(C)C.N#CC1=CC=C(C(=O)N=C=O)C=C1 Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CCCCS(=O)(=O)N[C@@H](CC1=CC=C(NC(=O)NC(=O)C2=CC=C(C#N)C=C2)C=C1)C(=O)OC(C)(C)C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1CCOC1.CCN(CC)CC.CN(C)O.Cl.O.O=C(O)C1=C(O)C=CC=C1Cl as the reactants and reagents.",
"input": "",
"output": " CN(C)OC(=O)C1=C(O)C=CC=C1Cl ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC(C)NC(C)C.CC1=CC=CC=C1.CCOCC.COC1=CC(C)=C(C=O)C(OC)=C1OC.FC(F)(F)C1=CC(Cl)=C(Cl)N=C1Cl.O.[Li]CCCC ",
"input": "",
"output": " COC1=CC(C)=C(C(O)C2=C(Cl)C(Cl)=NC(Cl)=C2C(F)(F)F)C(OC)=C1OC ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " COC(=O)C[C@H](C)CC(=O)O.COC(=O)Cl Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be COC(=O)C(C(=O)OC)[C@H](C)CC(=O)O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C1=CC=CC=C1.CCCCN.O=C1C2=C(CCCC2)C(=O)N1C1=CC(OC2CCCC2)=C(Cl)C=C1F is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CCCCNC(=O)C1=C(C(=O)NC2=CC(OC3CCCC3)=C(Cl)C=C2F)CCCC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.CC(C)(C)OC(=O)N1CCC(=CC2=CC=CC(Br)=C2)CC1.[Pd] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CC(C)(C)OC(=O)N1CCC(CC2=CC=CC(Br)=C2)CC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC#N.CCCCP(CCCC)OC1=CC=C(C(C)(C)C)C=C1C(C)(C)C.O is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CCCC[PH](=O)CCCC ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: BrCC1=CC=CC=C1.CCOC(C)=O.CN(C)C=O.COC1=CC=C(C=O)C2=C1NC(=O)CC2.O.[H-].[Na+] , what product could potentially be produced?",
"input": "",
"output": "The product can be COC1=CC=C(C=O)C2=C1N(CC1=CC=CC=C1)C(=O)CC2 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC1(C)OB(C2=NNC3=CC=CC=C23)OC1(C)C.CN(C)CCN(C)C1=NC(Cl)=NC2=C1C=NN2C is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CN(C)CCN(C)C1=NC(C2=CC=CC3=C2C=NN3)=NC2=C1C=NN2C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(=O)CCCO[Si](C)(C)C(C)(C)C.CCOC(=O)C(=O)OCC.CC[O-].[Na+] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CCOC(=O)C(=O)CC(=O)CCCO[Si](C)(C)C(C)(C)C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3C[C@@H]4OC45C[C@@H](O)CC[C@]5(C)[C@H]3CC[C@]12C.CCCCO.COC(C)(C)C.NCCC1=CNC2=CC=CC=C12 ",
"input": "",
"output": " CCCN[C@@H]1C[C@H]2[C@@H]3CC[C@H]([C@H](C)CCCC(C)C)[C@@]3(C)CC[C@@H]2[C@@]2(C)CC[C@H](O)C[C@]12O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CN(C)C(=N)NC1=NC(=O)C(=CC2=CC=C(N3CCC(=O)CC3)C=C2)S1.NC[C@H](O)COC1=CC=CC=C1 ",
"input": "",
"output": " CN(C)C(=N)NC1=NC(=O)C(=CC2=CC=C(N3CCC(NC[C@H](O)COC4=CC=CC=C4)CC3)C=C2)S1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CCOC(=O)C(C)N1CC[C@@H](NC(=O)C2=CC=C(Cl)S2)C1.NC1=CC=C(N2C=CC=CC2=O)C=C1F is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC(C(=O)NC1=CC=C(N2C=CC=CC2=O)C=C1F)N1CC[C@@H](NC(=O)C2=CC=C(Cl)S2)C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC1=CC=CC=C1.CCNC1=CC=C(Cl)N=C1.CN=C=O Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CCN(C(=O)NC)C1=CC=C(Cl)N=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C[C@H](COCC1=CC=C(F)C=C1)NC(=O)OC(C)(C)C.ClCCl.O=C(O)C(F)(F)F as the reactants and reagents.",
"input": "",
"output": " C[C@@H](N)COCC1=CC=C(F)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses BrCCCOCC1=CC=CC=C1.CC#N.COCCCOC1=CC(Br)=CC=C1O.O=C([O-])[O-].[I-].[K+].[Na+] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: COCCCOC1=CC(Br)=CC=C1OCCCOCC1=CC=CC=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(=O)O.CC(C)(C)OC(=O)NC1CCN(C2=CC=NC(Cl)=N2)CC1.CCO.[Pd] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CC(C)(C)OC(=O)NC1CCN(C2=CC=NC=N2)CC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1COCCO1.CC(C)(C)[O-].CN(C)C1=CC=CC=C1C1=CC=CC=C1P(C1CCCCC1)C1CCCCC1.COCCN1C=C(C2=CC=C3C(=C2)[C@H](N)C[C@H](C)N3C(C)=O)C=N1.ClC1=CC=C(Br)N=C1.O=C(/C=C/C1=CC=CC=C1)/C=C/C1=CC=CC=C1.[Na+].[Pd] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be COCCN1C=C(C2=CC=C3C(=C2)[C@H](NC2=CC=C(Cl)C=N2)C[C@H](C)N3C(C)=O)C=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CCOC(=O)COC1=CC=C(C2=NNC(=O)NC2C)C=C1Cl.NC1CCN(CC2=CC=CC=C2)CC1 as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CC1NC(=O)NN=C1C1=CC=C(OCC(=O)NC2CCN(CC3=CC=CC=C3)CC2)C(Cl)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1=CC=NC=C1.CCCOC1=CC=C2C(=C1)C(C1=CC=C(OC)C=C1OCOC)C(C(=O)O)C2C1=CC=C2OCOC2=C1.ClCCl.O=S(Cl)Cl.[O-][N+]1=CC=CC=C1S ",
"input": "",
"output": " CCCOC1=CC=C2C(=C1)C(C1=CC=C(OC)C=C1O)CC2C1=CC=C2OCOC2=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C1CCOC1.CN.CSC1=NC=C2C=C(C3=CC(NC(=O)NC4=C(C)N(C(C)(C)C)N=C4)=C(F)C=C3C)C(=O)N(C)C2=N1.O=C(OO)C1=CC=CC(Cl)=C1 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CNC1=NC=C2C=C(C3=CC(NC(=O)NC4=C(C)N(C(C)(C)C)N=C4)=C(F)C=C3C)C(=O)N(C)C2=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C1COCCO1.CC(C)(C)OC(=O)CN.CCN(C(C)C)C(C)C.CCOC(=O)C1=C(O)C2=CC(Cl)=CC=C2C(C)(C2=CC=C(Cl)C=C2)C1=O.Cl.O as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CC(C)(C)OC(=O)CNC(=O)C1=C(O)C2=CC(Cl)=CC=C2C(C)(C2=CC=C(Cl)C=C2)C1=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1=CC=C(P(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.CCCC1=CC(OCCCBr)=CC(C(C)=O)=C1O as the reactants and reagents.",
"input": "",
"output": " CCCC1=CC(OCCC[P+](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)=CC(C(C)=O)=C1O.[Br-] ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(=O)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C.C[C@]12CCC(=O)C[C@@H]1CC[C@@H]1[C@@H]2CC[C@]2(C)[C@@H](O)CC[C@@H]12 Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " C[C@]12C[C@@H](O)[C@H]3[C@@H](CCC4=CC(=O)CC[C@@]43C)[C@@H]1CC[C@@H]2O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CO.COC(OC)C(C#N)=CC1CCCCC1.[H][H].[Pd] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " COC(OC)C(C#N)CC1CCCCC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1CCC2=NCCCN2CC1.CCCCC1=NN(C2=CC([N+](=O)[O-])=CC=C2Cl)C(=O)N1CC1=CC=C(C2=CC=CC=C2S(N)(=O)=O)C=C1.O=C(N1C=CN=C1)N1C=CN=C1.O=C(O)C1=CC=CC=C1Cl ",
"input": "",
"output": " CCCCC1=NN(C2=CC([N+](=O)[O-])=CC=C2Cl)C(=O)N1CC1=CC=C(C2=CC=CC=C2S(=O)(=O)NC(=O)C2=CC=CC=C2Cl)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C1=CC=C(P(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.C1=CC=NC=C1.CS(=O)(=O)C1=CC=C(/C(=C\\C2CCCC2)C(=O)O)C=C1Cl.ClCCl.NC1=NC=CS1.O.O=C1CCC(=O)N1Br as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CS(=O)(=O)C1=CC=C(/C(=C\\C2CCCC2)C(=O)NC2=NC=CS2)C=C1Cl ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C1CCOC1.CN.CSC1=NCC(C2=CC=C([N+](=O)[O-])C=C2)C2=CC(Cl)=CC=C12 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CNC1=NCC(C2=CC=C([N+](=O)[O-])C=C2)C2=CC(Cl)=CC=C12 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CCBr.COC(C)(C)C.C[C@@H](C=NNC=O)OCC1=CC=CC=C1.II is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC[C@H](NNC=O)[C@H](C)OCC1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1CCOC1.CCCCP(CCCC)CCCC.CN1C=CN=C1S.O.O=C(N=NC(=O)N1CCCCC1)N1CCCCC1.OCC1=CC=CC2=C1NC(C1=NC=CS1)=C2 ",
"input": "",
"output": " CN1C=CN=C1SCC1=CC=CC2=C1NC(C1=NC=CS1)=C2 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C=CC.C=CC=C.O=C(O)O as the reactants and reagents.",
"input": "",
"output": " C=CC1COC(=O)O1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1COCCO1.COC(=O)C(OC1=NC(C)=CC(OC)=N1)C(OCC(C)(C)C(=O)OC)(C1=CC=CC=C1)C1=CC=CC=C1.O.[Na+].[OH-] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be COC1=CC(C)=NC(OC(C(=O)O)C(OCC(C)(C)C(=O)O)(C2=CC=CC=C2)C2=CC=CC=C2)=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CC(=O)O.CCO.Cl.O=CC1=CC=CC(NC2=CC=CC=C2)=C1.[C-]#N.[K+] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " N#CC(O)C1=CC=CC(NC2=CC=CC=C2)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC1=CC=C(S(=O)(=O)O)C=C1.CC1=CC=CC=C1.CN1C2=C(C=CC1=O)C(=O)CCC2.NCCC1=CC=C(Cl)C=C1Cl ",
"input": "",
"output": " CN1C2=C(C=CC1=O)C(NCCC1=CC=C(Cl)C=C1Cl)CCC2 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CC1=CC=CC2=C1C(Br)=NS2.CCOC(C)=O.CO.NCCCN as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CC1=CC=CC2=C1C(NCCCN)=NS2 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CCO.CCOC(=O)CS.CCOC(C)N1N=C(Br)C(C=O)=C1Br.O=C([O-])[O-].[Na+] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CCOC(=O)C1=CC2=C(S1)N(C(C)OCC)N=C2Br ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC1=CC=C(S(=O)(=O)OCCC2=C(C)OC(C3=CC=CC(C4=CC=CS4)=C3)=N2)C=C1.CCO.CCOC(=O)C(C)(CC1=CC=C(O)C=C1)OC1=CC=C(Cl)C=C1.O=C([O-])[O-].[K+].[Na+].[OH-] ",
"input": "",
"output": " CC1=C(CCOC2=CC=C(CC(C)(OC3=CC=C(Cl)C=C3)C(=O)O)C=C2)N=C(C2=CC=CC(C3=CC=CS3)=C2)O1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1COCCO1.CC1(C)OB(C2=CC=CC3=C2CCN(S(=O)(=O)NC2=NC=NS2)C3)OC1(C)C.CCOC(C)=O.FC(F)(F)C1=CC=C(Br)C(N2CCOCC2)=C1.O.O=P([O-])([O-])[O-].[K+] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " O=S(=O)(NC1=NC=NS1)N1CCC2=C(C=CC=C2C2=CC=C(C(F)(F)F)C=C2N2CCOCC2)C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C#CC(C)(C)C.CC(=O)NC1=CC=CC=C1Br.CCN(CC)CC.Cl[Pd](Cl)([PH](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1)[PH](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1.O.[Cu]I Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CC(=O)NC1=CC=CC=C1C#CC(C)(C)C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CCN=C=NCCCN(C)C.CN(C)C1=CC=NC=C1.COC1(CN2N=CC(C3=CC=C(N4CCC5=CC=CC(C(=O)NC6=NC7=CC=CC=C7S6)=C5C4)N=C3C(=O)O)=C2C)CCCC(C)(C)C1.CS(N)(=O)=O.Cl.ClCCl , what product could potentially be produced?",
"input": "",
"output": "The product can be COC1(CN2N=CC(C3=CC=C(N4CCC5=CC=CC(C(=O)NC6=NC7=CC=CC=C7S6)=C5C4)N=C3C(=O)NS(C)(=O)=O)=C2C)CCCC(C)(C)C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CO.ClCCl.O=C(O)C(CC1CCC1)C(=O)O ",
"input": "",
"output": " O=C(O)CCC1CCC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CCS(N)(=O)=O.O=C(O)C1=C2N=CC(C(=O)N3CCC(C4=CC=CC=C4)CC3)=C(NC3=CC=CC4=CC=CN=C34)N2N=C1 ",
"input": "",
"output": " CCS(=O)(=O)NC(=O)C1=C2N=CC(C(=O)N3CCC(C4=CC=CC=C4)CC3)=C(NC3=CC=CC4=CC=CN=C34)N2N=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C1=CC=NC=C1.C1CCOC1.CC(C)(C)OC(=O)NC(CC1=CC=C(OC(C)(C)C)C=C1)C1CC=CC(C(CC2=CC=CC=C2)C(=O)SCC2=CC=CC=C2)O[Si](C)(C)O1.OO.[Li+].[OH-] , what product could potentially be produced?",
"input": "",
"output": "The product can be NC(CC1=CC=C(O)C=C1)C(O)C/C=C\\C(O)C(CC1=CC=CC=C1)C(=O)O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C.CCCNC(=O)ON=C1CN(C2=CC=CC=C2F)C2=CC=CC=C2N(COC)C1=O.CO.[Pd] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " COCN1C(=O)C(N)CN(C2=CC=CC=C2F)C2=CC=CC=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CCCO.CCN(CC)C1=CC=C(C#N)C=N1.Cl .",
"input": "",
"output": " CCCOC(=N)C1=CC=C(N(CC)CC)N=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.CC(C)[N-]C(C)C.CCOC(C)=O.O=C(Cl)OCC1=CC=CC=C1.O=C1CCCCCN1C1=CC=C(F)C=C1.[Li+] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be O=C(OCC1=CC=CC=C1)C1CCCCN(C2=CC=C(F)C=C2)C1=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC(=O)O.COC1=CC=CC=C1C.O=C(NC(O)C(=O)O)OCC1=CC=CC=C1.O=S(=O)(O)O is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " COC1=CC=C(C(NC(=O)OCC2=CC=CC=C2)C(=O)O)C=C1C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. COC(=O)NC(C(=O)N1CCCC1C1=NC=C(C2=CC=C3C=C(C4=CC=C5C(=C4)OCC4=C5N=C(C5CCCN5C(=O)C(NC(=O)OC)C(C)C)N4)C=CC3=C2)N1)C1=CC=CC=C1.COC(=O)NC(C(=O)O)C1=CC=CC=C1 ",
"input": "",
"output": " COC(=O)NC(C(=O)N1CCCC1C1=NC2=C(N1)C1=CC=C(C3=CC=C4C=C(C5=CN=C(C6CCCN6C(=O)C(NC(=O)OC)C(C)C)N5)C=CC4=C3)C=C1OC2)C1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CC1=CC(C)=CC(C#CC2=CC([N+](=O)[O-])=CC=C2N)=C1.Cl[Pd]Cl as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CC1=CC(C)=CC(C2=CC3=CC([N+](=O)[O-])=CC=C3N2)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C=CCCCCCCBr.CC(C)=O.CCCCCCCCC1=CN=C(C2=CC=C(O)C(F)=C2F)N=C1.O=C([O-])[O-].[Cs+] .",
"input": "",
"output": " C=CCCCCCCOC1=CC=C(C2=NC=C(CCCCCCCC)C=N2)C(F)=C1F ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CC=NC=C1.CCOC(C)=O.NC1=NNC(C2=CC=CC=C2)=C1.O=C(Cl)CCC1=CC=CC=C1 Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " O=C(CCC1=CC=CC=C1)NC1=NNC(C2=CC=CC=C2)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1COCCO1.CCOP(C)(=O)C1=CC=CC([C@H](NC(=O)C2=CN=C(N3C=CC=N3)N=C2O)C2=CC=CC=C2)=C1.CCOP(C)(=O)C1=CC=CC=C1[C@H](NC(=O)C1=CN=C(N2C=CC=N2)N=C1O)C1=CC=CC=C1.[Na+].[OH-] ",
"input": "",
"output": " CP(=O)(O)C1=CC=CC([C@H](NC(=O)C2=CN=C(N3C=CC=N3)N=C2O)C2=CC=CC=C2)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C1COCCO1.CCOP(C)(=O)C1=CC=CC([C@@H](NC(=O)C2=CN=C(N3C=CC=N3)N=C2O)C2=CC=CC=C2)=C1.CCOP(C)(=O)C1=CC=CC=C1[C@@H](NC(=O)C1=CN=C(N2C=CC=N2)N=C1O)C1=CC=CC=C1.[Na+].[OH-] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CP(=O)(O)C1=CC=CC([C@@H](NC(=O)C2=CN=C(N3C=CC=N3)N=C2O)C2=CC=CC=C2)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC(C)(C)C1=CC=C(O)C(C(C)(C)C2=CC=C(Cl)C=C2)=C1.N#[N+]C1=CC=CC=C1[N+](=O)[O-].O=S(=O)([O-])O , what product could potentially be produced?",
"input": "",
"output": "The product can be CC(C)(C)C1=CC(N=NC2=CC=CC=C2[N+](=O)[O-])=C(O)C(C(C)(C)C2=CC=C(Cl)C=C2)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CCN(C(C)C)C(C)C.CS(=O)(=O)Cl.ClCCl.O.OCCOCC1=CC=C(Cl)C=C1 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CS(=O)(=O)OCCOCC1=CC=C(Cl)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " BrC1=NC=C(Br)C2=C1C=CO2.C1=CC=C([PH](C2=CC=CC=C2)(C2=CC=CC=C2)[Pd]([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)[PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.CCOC(C)=O.CN(C)C=O.O.O=CO[Na] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be BrC1=CN=CC2=C1OC=C2 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCN(C(C)C)C(C)C.CCOC(=O)C1(C(=O)OCC)CCC(O)CC1.COCCl.ClCCl Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CCOC(=O)C1(C(=O)OCC)CCC(OCOC)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C1CCOC1.CC1=CC=CC=C1N1CCN(C(=O)OC(C)(C)C)C(CCOS(C)(=O)=O)C1.C[S-].[Na+] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CSCCC1CN(C2=CC=CC=C2C)CCN1C(=O)OC(C)(C)C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " O.O=C(C1=CC=CC=C1)N1CCC2NC3=CC(Cl)=C(Cl)C=C3C2CC1.OCCO.[K+].[OH-] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be ClC1=CC2=C(C=C1Cl)[C@@H]1CCNCC[C@H]1N2 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CCOC(C)=O.COC(=O)C1=CC([N+](=O)[O-])=C(C)S1.[H][H].[Pd] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " COC(=O)C1=CC(N)=C(C)S1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C1CCOC1.CCOC(=O)CC(=O)OCC.Cl.ClCCCCBr.[H-].[Na+] , what product could potentially be produced?",
"input": "",
"output": "The product can be CCOC(=O)C(CCCCCl)C(=O)OCC .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1COCCO1.Cl.N#CN.NC1=CC=CC(C2=CC=CC(NC(=O)CCCCC(=O)O)=C2)=C1 ",
"input": "",
"output": " N=C(N)NC1=CC=CC(C2=CC=CC(NC(=O)CCCCC(=O)O)=C2)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CCC1=CC=C2C(=C1)C=CC1=C(N=C(C)O1)C2C1=CNC(=O)NC1=O.CN(C)C=O.ClC1=CC=NC(Cl)=N1.O=C([O-])[O-].[Cs+] ",
"input": "",
"output": " CCC1=CC=C2C(=C1)C=CC1=C(N=C(C)O1)C2C1=CN(C2=CC=NC(Cl)=N2)C(=O)NC1=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. C1CCOC1.CC(C)CN1C(=O)N(C)C(=O)C2=C(SCCCC(=O)O)N(CC3=CC=CC4=CC=CC=C34)C=C21.CCN(CC)CC.CCOC(=O)Cl ",
"input": "",
"output": " CC(C)CN1C(=O)N(C)C(=O)C2=C(SCCCC(N)=O)N(CC3=CC=CC4=CC=CC=C34)C=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC(C)C(=O)NC1=CC=CC(C2CCN(CC3=CC=CC4=C3C=CN4)CC2)=C1.FC1=CC=CC=C1I , what product could potentially be produced?",
"input": "",
"output": "The product can be CC(C)C(=O)NC1=CC=CC(C2CCN(CC3=CC=CC4=C3C=CN4C3=CC=CC=C3F)CC2)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C=C[Sn](CCCC)(CCCC)CCCC.CN(C)C=O.Cl[Pd](Cl)([PH](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1)[PH](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1.FC1=CC=CC2=C1C=C(C1=CC(Cl)=NN=C1Cl)N2.[Cl-].[Li+] ",
"input": "",
"output": " C=CC1=NN=C(Cl)C=C1C1=CC2=C(F)C=CC=C2N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC1=CC=CC=C1C.CCOC(=O)C1=CC=C(C(=O)CNC(=O)C2=CC=C(C(F)(F)F)C=C2)C=C1.COC1=CC=C(P2(=S)SP(=S)(C3=CC=C(OC)C=C3)S2)C=C1 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CCOC(=O)C1=CC=C(C2=CN=C(C3=CC=C(C(F)(F)F)C=C3)S2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC1=C(C(=O)O)OC=C1.FC(F)(F)C1=CC=C(N2CC3CNCC3C2)N=C1 .",
"input": "",
"output": " CC1=C(C(=O)N2CC3CN(C4=CC=C(C(F)(F)F)C=N4)CC3C2)OC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)(C)OC(=O)N[C@H]1CC[C@@H](O)C1.CCI.CN(C)C=O.[H-].[Na+] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CCO[C@@H]1CC[C@H](NC(=O)OC(C)(C)C)C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CNCCOC1=CC=CC2=NC=NC(NC3=CC=C(OCC4=CC=CC=N4)C(Cl)=C3)=C12.C[C@@H](O)CN.OC1=CC=C(NC2=NC=NC3=CC=CC(F)=C23)C=C1Cl as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: C[C@H](CN)OC1=CC=CC2=NC=NC(NC3=CC=C(O)C(Cl)=C3)=C12 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC1=CC=CC=C1.CC1C(=O)CCC1=O.NC1=CC=C(C2=NNC(=O)CC2)C=C1.O ",
"input": "",
"output": " CC1=C(NC2=CC=C(C3=NNC(=O)CC3)C=C2)CCC1=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CC=C([PH](C2=CC=CC=C2)(C2=CC=CC=C2)[Pd]([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)[PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.C1COCCO1.CC(=O)NC1=NC2=CC=C(B3OC(C)(C)C(C)(C)O3)C=C2S1.ClC1=CC=NC(Cl)=N1.O=C([O-])[O-].[Na+] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CC(=O)NC1=NC2=CC=C(C3=CC=NC(Cl)=N3)C=C2S1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CCOC(OCC)C(C)C=C(C#N)C#N.CCOC=C(C)C=C(C#N)C#N.N is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC1=CC=NC(N)=C1C#N ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C1CCN(CC2CCCN2)CC1.CN1CCCC1=O.ClC1=CC2=C(C=N1)C1=NC(C3=CC=CC=N3)=CN1CCO2 , what product could potentially be produced?",
"input": "",
"output": "The product can be C1=CC=C(C2=CN3CCOC4=CC(N5CCCC5CN5CCCCC5)=NC=C4C3=N2)N=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC#N.COC(=O)CC1=C(C(=O)OC)C=CC(N)=C1Cl.COC(=O)CC1=CC(N)=CC=C1C(=O)OC.O.O=C1CCC(=O)N1Cl Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be COC(=O)CC1=CC(N)=C(Cl)C=C1C(=O)OC .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if O=C(CCC1=CC=CC=C1)CN1C(=O)CC1SCCO.O=C(OO)C1=CC=CC(Cl)=C1 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " O=C(CCC1=CC=CC=C1)CN1C(=O)CC1S(=O)CCO ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CCN(CC)CC.CCOC(=O)[C@H]1CC[C@@H](NC(=O)C2(CC(N)C(=O)OC(C)(C)C)CCCC2)CC1.ClCCl.O=S(=O)(Cl)C1=CC=CC=C1 , what product could potentially be produced?",
"input": "",
"output": "The product can be CCOC(=O)[C@H]1CC[C@@H](NC(=O)C2(CC(NS(=O)(=O)C3=CC=CC=C3)C(=O)OC(C)(C)C)CCCC2)CC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCN(CC)CC.CO.COC1=CC=C(C2=C(Cl)C(=O)C2)C=C1.[Pd] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be COC1=CC=C(C2CC(=O)C2)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C1CCOC1.CC1(C)OC[C@H](CCNC(=O)C2NC(CC(C)(C)C3=CCOCC3)C(C#N)(C3=CC=C(Cl)C=C3F)C2C2=CC=CC(Cl)=C2F)O1.Cl is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC(C)(CC1NC(C(=O)NCC[C@H](O)CO)C(C2=CC=CC(Cl)=C2F)C1(C#N)C1=CC=C(Cl)C=C1F)C1=CCOCC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) BrC1=CC=C(C2CCCN2)C=C1.CCN(CC)CC.CS(=O)(=O)Cl.Cl.ClCCl as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CS(=O)(=O)N1CCCC1C1=CC=C(Br)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1CCOC1.CCOC(=O)C1=CN=NC=C1C.Cl.O.[Na+].[OH-] ",
"input": "",
"output": " CC1=CN=NC=C1C(=O)O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C[C@@]1(C(=O)NC2=CC=C(F)N=C2)CCCN1C1=NC(Cl)=NC(NC2=CC(C3CC3)=NN2)=N1.ClC1=NC(Cl)=NC(NC2=CC(C3CC3)=NN2)=N1.O=C(NC1=CN=CC=N1)[C@@H]1C[C@@H]2C[C@@H]2N1 as the reactants and reagents.",
"input": "",
"output": " O=C(NC1=CN=CC=N1)[C@@H]1C[C@@H]2C[C@@H]2N1C1=NC(Cl)=NC(NC2=CC(C3CC3)=NN2)=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1COCCN1.C1COCCO1.CC(C)C1=CC(C(C)C)=C(C2=CC=CC=C2P(C2CCCCC2)C2CCCCC2)C(C(C)C)=C1.CC1=NC2=C([N+](=O)[O-])C=C(Br)C=C2N1CC1=CC=CC2=CC=CC=C12.O=C(/C=C/C1=CC=CC=C1)/C=C/C1=CC=CC=C1.O=C([O-])[O-].[Cs+].[Pd] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CC1=NC2=C([N+](=O)[O-])C=C(N3CCOCC3)C=C2N1CC1=CC=CC2=CC=CC=C12 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CCC1=CC=C2NC=C(CCNC(C)=O)C2=C1.O=C1C=C(O)C(C2=CC=CC=C2)C1.O=CC1=CC=CC=C1 .",
"input": "",
"output": " CCC1=CC=C2NC(C(C3=C(O)C(C4=CC=CC=C4)CC3=O)C3=CC=CC=C3)=C(CCNC(C)=O)C2=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CO.O.O=C(O)C(=O)CC1=C(I)C=CC=C1[N+](=O)[O-].OO as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " O=C(O)CC1=C(I)C=CC=C1[N+](=O)[O-] ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CCOC(C)=O.Cl.O=C1C2=CC=CC=C2SC2=CC(OCC3CS3)=CC(O)=C12 , what product could potentially be produced?",
"input": "",
"output": "The product can be O=C1C2=CC=CC=C2SC2=CC(OCC(S)CCl)=CC(O)=C12 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CC=NC=C1.CC1=NN(C)C=C1N.O=S(=O)(Cl)C1=CC=C(Br)C=C1 Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CC1=NN(C)C=C1NS(=O)(=O)C1=CC=C(Br)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C1CCOC1.C=CCOCCOCCO.COC(=O)CBr.[H-].[Na+] .",
"input": "",
"output": " C=CCOCCOCCOCC(=O)OC ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C1=CC=CC=C1.CC1=CC=C(S(=O)(=O)O)C=C1.CCOC(=O)C(C#N)CC(=O)CC.O.OCCO as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CCOC(=O)C(C#N)CC1(CC)OCCO1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C1COCCO1.CCOC(=O)CBr.O=C1C[C@H](C2=CC=CC=C2)CN1.[H-].[Na+] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CCOC(=O)CN1C[C@@H](C2=CC=CC=C2)CC1=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC(=O)OC(C)=O.CCOC(OCC)OCC.C[C@H]1CC[C@H](CNC2=C(N)C=C(Cl)N=C2Cl)CC1 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: C[C@H]1CC[C@H](CN2C=NC3=CC(Cl)=NC(Cl)=C32)CC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C1CCOC1.CC(=O)O.CC(C)(C)OC(=O)N1CCC(C(=O)O)(C2=CC=CC=C2)CC1.CC(C)[Mg]Cl.N#CCC(=O)O.O.O=C(N1C=CN=C1)N1C=CN=C1 .",
"input": "",
"output": " CC(C)(C)OC(=O)N1CCC(C(=O)CC#N)(C2=CC=CC=C2)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC(C)(C)[O-].CC1=CC=C(C2=CC3=CC=CC=C3O2)C=C1.CN(C)C=O.O=CC1=CC=C(C(=O)O)C=C1.[K+] ",
"input": "",
"output": " O=C(O)C1=CC=C(C=CC2=CC=C(C3=CC4=CC=CC=C4O3)C=C2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CCCOC1=CC=CC=C1C(=O)NC1=C(I)C=CC=C1C(=O)OC.NC=O.O ",
"input": "",
"output": " CCCOC1=CC=CC=C1C1=NC2=C(I)C=CC=C2C(=O)N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC1=CC(C2=CN(CCN3CCC3)C(C3CCNCC3)=N2)=CC=C1F.COC1=CC(C2=CN(CCN3CCC3)C(C3CCN(C4=NC=NC(N)=C4C#N)CC3)=N2)=CC=C1F.COC1=CC(C2=CN(CCN3CCC3)C(C3CCNCC3)=N2)=CC=C1F.Cl Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CC1=CC(C2=CN(CCN3CCC3)C(C3CCN(C4=NC=NC(N)=C4C#N)CC3)=N2)=CC=C1F ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CC=NC=C1.C1CCOC1.CCOC(=O)/C=C(/C)N.O.O=C(Cl)CCl Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CCOC(=O)/C(C(=O)CCl)=C(\\C)N ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1CCOC1.NNCCO.O=C=NC1CCCCC1 ",
"input": "",
"output": " NN(CCO)C(=O)NC1CCCCC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCC1=CC=NC(Cl)=C1.CCCCCC1=CC(C)=CC=N1 Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CCCCCC1=CC(CC)=CC=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CCC1=CC=C(CC(C)(C)N)C=C1.CCOC(O)C(=O)C1=CC(OCC2=CC=CC=C2)=CC2=C1OCC(=O)N2.Cl , what product could potentially be produced?",
"input": "",
"output": "The product can be CCC1=CC=C(CC(C)(C)NCC(O)C2=CC(OCC3=CC=CC=C3)=CC3=C2OCC(=O)N3)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCOC1=CC=C(CC2=CC([C@]34OC[C@](C(=O)O)(O3)[C@@H](OCC3=CC=CC=C3)[C@H](OCC3=CC=CC=C3)[C@H]4OCC3=CC=CC=C3)=CC=C2Cl)C=C1.CO.O=S(=O)(O)O Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CCOC1=CC=C(CC2=CC([C@]34OC[C@](C(=O)OC)(O3)[C@@H](OCC3=CC=CC=C3)[C@H](OCC3=CC=CC=C3)[C@H]4OCC3=CC=CC=C3)=CC=C2Cl)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC(=O)OCC(OC(C)=O)C(=[N+]=[N-])C(C)=O.CC(C)=O.CC1(C)OO1 ",
"input": "",
"output": " CC(=O)OCC(OC(C)=O)C(=O)C(C)=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CCO.CCOC(=O)N1C2=CC(C(=O)OC)=CC=C2C(=O)N1C.[K+].[OH-] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CN1NC2=CC(C(=O)O)=CC=C2C1=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " O=C(NNC(=O)C1=CC=C(Br)C=C1)C1=CC=CC=C1.O=P(Cl)(Cl)Cl Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be BrC1=CC=C(C2=NN=C(C3=CC=CC=C3)O2)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CCO.O=C(OCC1=CC=CC=C1)N1CCC(CNC2=C(Cl)C(Cl)=NC(Cl)=C2Cl)C(O)C1.O=C([O-])[O-].[K+].[Pd] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: OC1CNCCC1CNC1=CC=NC=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCN=C=NCCCN(C)C.CN(C)C1=CC=NC=C1.Cl.ClCCl.NN1CCOCC1.O=C(O)[C@@H]1CC[C@@H]2CN1C(=O)N2OCC1=CC=CC=C1.ON1N=NC2=CC=CC=C21 Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be O=C(NN1CCOCC1)[C@@H]1CC[C@@H]2CN1C(=O)N2OCC1=CC=CC=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C1CCOC1.CO.FC(F)(F)C1=CC=CC(C#CC2=CC(OCC3=CC=CC=C3)=C(OCC3=CC=CC=C3)N=N2)=C1 .",
"input": "",
"output": " O=C1NN=C(CCC2=CC=CC(C(F)(F)F)=C2)C=C1O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CCO.CCOC(=O)C(=O)CC(=O)C1=CC(CC2=CC=CC=C2)=CC(OC)=C1OC.[Na+].[OH-] ",
"input": "",
"output": " COC1=CC(CC2=CC=CC=C2)=CC(C(=O)CC(=O)C(=O)O)=C1OC ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with BrCCCCCCOCCCCC1=CC=CC=C1.CCC1=NNC2=CC(C(=O)OC)=CC=C12 as the reactants and reagents.",
"input": "",
"output": " CCC1=NN(CCCCCCOCCCCC2=CC=CC=C2)C2=CC(C(=O)OC)=CC=C12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC1(C)OCC2CNCCN21.CN(C)C=O.FC1=CC=C(C(CCCI)C2=CC=C(F)C=C2)C=C1.O=C([O-])[O-].[Na+] , what product could potentially be produced?",
"input": "",
"output": "The product can be CC1(C)OCC2CN(CCCC(C3=CC=C(F)C=C3)C3=CC=C(F)C=C3)CCN21 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC(=O)N(C)C.CCOC(=O)C1=CC(F)=C(N2CCCC2)N=C1Cl.ClCCl.NC1CC1 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CCOC(=O)C1=CC(F)=C(N2CCCC2)N=C1NC1CC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC#N.CC(=O)OC[C@H]1O[C@H](Br)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O.COC1=CC=C(CC2=C(C)N=C(C)NC2=O)C=C1.O=C([O-])[O-].[K+] as the reactants and reagents.",
"input": "",
"output": " COC1=CC=C(CC2=C(C)N=C(C)N=C2O[C@@H]2O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]2OC(C)=O)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C1CCOC1.CC1=CC=C(N)N=C1.CCOC(=O)[C@H](CCN(C)C)O[Si](C)(C)C(C)(C)C.CCOC(C)=O.O.[Li]CCCC .",
"input": "",
"output": " CC1=CC=C(NC(=O)[C@H](CCN(C)C)O[Si](C)(C)C(C)(C)C)N=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " BrBr.CC(=O)Cl.CCO[C@H]1C[C@@]2(C)[C@@H](CC[C@H]3[C@@H]4CC[C@H](C(C)=O)[C@@]4(C)CC(=O)[C@@H]32)C[C@@H]1O.CO.O Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CCO[C@H]1C[C@@]2(C)[C@@H](CC[C@H]3[C@@H]4CC[C@H](C(=O)CBr)[C@@]4(C)CC(=O)[C@@H]32)C[C@@H]1O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC#N.CCN(CC)S(F)(F)F.C[N+](=O)[O-].OC1(C2=CC=C3CNCC3=C2)COC1 .",
"input": "",
"output": " FC1(C2=CC=C3CNCC3=C2)COC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC(C)(C)OC(=O)N[C@@H](CSC1=C([N+](=O)[O-])C=CC=C1[N+](=O)[O-])C(=O)O.CO.O.[Cl-].[NH4+].[Zn] ",
"input": "",
"output": " CC(C)(C)OC(=O)N[C@@H](CSC1=C(N)C=CC=C1N)C(=O)O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CN(C)C=O.COC(=O)C(=O)C1=CC=C(O)C=C1.ClCC1=CC2=CC=CC=C2O1.O.[H-].[Na+] ",
"input": "",
"output": " O=C(O)C(=O)C1=CC=C(OCC2=CC3=CC=CC=C3O2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C1=CC=C(CN2CCNCC2)C=C1.CN(C)C=O.CS(=O)(=O)OCC1=CC=C(C(=O)/C=C/C2=CC=C(/C=C/C(=O)NOC3CCCCO3)C=C2)C=C1.O is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " O=C(/C=C/C1=CC=C(/C=C/C(=O)C2=CC=C(CN3CCN(CC4=CC=CC=C4)CC3)C=C2)C=C1)NO ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CN(C)S(=O)(=O)Cl.COC1=CC=C(NC(=O)C2=CC=C(N)C=C2NC(=O)C2=CC=C(C(C)(C)C)C=C2)C=C1 as the reactants and reagents.",
"input": "",
"output": " COC1=CC=C(NC(=O)C2=CC=C(NS(=O)(=O)N(C)C)C=C2NC(=O)C2=CC=C(C(C)(C)C)C=C2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1CCOC1.C=C(C)C1=NC2=C(C(C3CCCC3)=C1C1=CC(C=O)=CC=C1C(F)(F)F)[C@@H](O[Si](C)(C)C(C)(C)C)CC(C)(C)C2.CCOC(C)=O.Cl.[H-].[LiH].[NH4+] ",
"input": "",
"output": " C=C(C)C1=NC2=C(C(C3CCCC3)=C1C1=CC(CO)=CC=C1C(F)(F)F)[C@@H](O[Si](C)(C)C(C)(C)C)CC(C)(C)C2 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. C1CCNCC1.ClCCl.O=C1OC(C2=CC=CC=C2)(C2=CC=CC=C2)CC(O)=C1Br.SC1=CC=CC=C1 ",
"input": "",
"output": " O=C1OC(C2=CC=CC=C2)(C2=CC=CC=C2)CC(O)=C1SC1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C=CC1COC(=O)C1.CC(=O)[O-].CO.[Na+] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be C=CC(CO)CC(=O)OC .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CCOC(=O)NCC1(O)CCN(CCC2=COC3=CC=C(F)C=C23)CC1.FC1=CC=C2OC=C(CCBr)C2=C1 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: NCC1(O)CCN(CCC2=COC3=CC=C(F)C=C23)CC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C[Si](C)(C)CCOCCl.FC(F)(F)C1=CNC=N1.[H-].[Na+] as the reactants and reagents.",
"input": "",
"output": " C[Si](C)(C)CCOCN1C=NC(C(F)(F)F)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1CCCCC1.C1CCOC1.CC1=CC=C(Br)C=C1C.N#CC1=CC=C([C@H]2CC(=O)C3=CN=CN32)C(F)=C1.[Li]C(C)CC ",
"input": "",
"output": " CC1=CC=C([C@@]2(O)C[C@H](C3=CC=C(C#N)C=C3F)N3C=NC=C32)C=C1C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CCP(=O)(C#N)CC.CN(C)C=O.COC(=O)CCC1=CC=C(C2=NC(C3=CC=C(C(=N)N)C=C3)=CN2C)C=C1 ",
"input": "",
"output": " CCP(=O)(CC)NC(=N)C1=CC=C(C2=CN(C)C(C3=CC=C(CCC(=O)OC)C=C3)=N2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC(CO)C1=CC=CC=C1.CCOC(=O)C1(C2=CC=C(C3=CC=C(C4=C(CBr)C(C)=NO4)C=C3)C=C2)CC1 , what product could potentially be produced?",
"input": "",
"output": "The product can be CC1=NOC(C2=CC=C(C3=CC=C(C4(C(=O)O)CC4)C=C3)C=C2)=C1COCC(C)C1=CC=CC=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CCOC(=O)CNC1CCN(C(=O)CN2C=C(NC(=O)C3=C4N=CC=CN4N=C3)C(C3=CC(Cl)=CC=C3OC(F)F)=N2)CC1.CO.[K+].[OH-] ",
"input": "",
"output": " O=C(O)CNC1CCN(C(=O)CN2C=C(NC(=O)C3=C4N=CC=CN4N=C3)C(C3=CC(Cl)=CC=C3OC(F)F)=N2)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. O=C(O)C1=CC=CC=C1O.O=S(=O)(O)Cl ",
"input": "",
"output": " O=C(O)C1=CC(S(=O)(=O)Cl)=CC=C1O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC1=CC=C(N)C=C1Br.COC(=O)C1=CC=C(CN2CCN(C)CC2)C=C1 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CC1=CC=C(NC(=O)C2=CC=C(CN3CCN(C)CC3)C=C2)C=C1Br .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. Br.BrBr.CC(=O)C1=CN=C2C=CC=NN12.CC(=O)O ",
"input": "",
"output": " O=C(C1=CN=C2C=CC=NN12)C(Br)Br ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1=CCCC1.CC(=O)[O-].CC1=CC=CC=C1P(C1=CC=CC=C1C)C1=CC=CC=C1C.CCN(CC)CC.CO.OCC1=CC=CC(I)=C1.[Pd+2] as the reactants and reagents.",
"input": "",
"output": " OCC1=CC=CC(C2CCCC2)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " BrC1=CC=C(Br)N=C1.C1=CC=NC=C1.Cl.NCCCN.O Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be NCCCNC1=CC=C(Br)C=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CC#N.CC(=O)C(N)=S.CC(C)(C)S(=O)N=C1CC(C2CCCOC2)OC2=CC=C(Br)C=C12 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CC1=NC2(CC(C3CCCOC3)OC3=CC=C(Br)C=C32)NC1=S .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. C1=CC=C(CN2C=CN=C2)C=C1.CC(=O)O.CCO.CSC(=S)NN.CSC(=S)NN=CC1=NC=CN1.O=CC1=NC=CN1.OCC1=NC=CN1 ",
"input": "",
"output": " S=C1NN=CC2=NC=CN12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " COC(=O)[C@@H](C)N.Cl.N#CC1=CC=CC=C1C1=CC=C(C=O)C=C1.[BH3-]C#N.[Na+] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " COC(=O)[C@@H](C)NCC1=CC=C(C2=CC=CC=C2C#N)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.CC1=CC=C(S(=O)(=O)OCC2CC3=C(OC(C)C)C=C(C(=O)NC4=NN(C)C=C4)C=C3O2)C=C1.CCN(CC)CC.CNC.Cl Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CC(C)OC1=CC(C(=O)NC2=NN(C)C=C2)=CC2=C1CC(CN(C)C)O2 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1CCOC1.CCC(=O)Cl.CCCN[C@H]1CCC2=C(OC)C=CC=C2[C@H]1C.CCN(CC)CC.CCOCC.[Al+3].[H-].[Li+] ",
"input": "",
"output": " CCCN(CCC)[C@H]1CCC2=C(OC)C=CC=C2[C@H]1C.Cl ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC(C)(C)N1N=CC(C(=O)NC2C3CC4CC(C3)CC2C4)=C1Cl.OC1CCNCC1 ",
"input": "",
"output": " CC(C)(C)N1N=CC(C(=O)NC2C3CC4CC(C3)CC2C4)=C1N1CCC(O)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC(=O)O.CC1=CC(C(=O)NC2CCNCC2)=CC(C)=C1C(=O)O.CCN(C(C)C)C(C)C.CCO.CCOC1=CC(C=O)=CC(OCC)=C1N1C=CC=C1.[BH3-]C#N.[Na+] .",
"input": "",
"output": " CCOC1=CC(CN2CCC(NC(=O)C3=CC(C)=C(C(=O)O)C(C)=C3)CC2)=CC(OCC)=C1N1C=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1CCOC1.CCOC1=CC(CN=[N+]=[N-])=C(C#N)C=C1C(=O)NC.CCP(CC)CC.N ",
"input": "",
"output": " CCOC1=CC2=C(C=C1C(=O)NC)C(N)=NC2 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. B.C1CCOC1.CC(C)(C#N)C1=CC=C(C(F)(F)F)C=C1[N+](=O)[O-] ",
"input": "",
"output": " CC(C)(CN)C1=CC=C(C(F)(F)F)C=C1[N+](=O)[O-] ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1=CC=C([PH](C2=CC=CC=C2)(C2=CC=CC=C2)[Pd]([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)[PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.CC#N.CCC1=NN(CC2=NN(CC)C=C2)C2=CC=CC(NC(=O)C3=CN=C4C=C(Br)C=CN34)=C12.CN(C)C=O.CN1C=C(B2OC(C)(C)C(C)(C)O2)C=N1.CO.ClCCl.O.O=C([O-])[O-].[K+] as the reactants and reagents.",
"input": "",
"output": " CCC1=NN(CC2=NN(CC)C=C2)C2=CC=CC(NC(=O)C3=CN=C4C=C(C5=CN(C)N=C5)C=CN34)=C12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC(C)(C)OC(=O)N1C=COC2=CC=C(C=O)C=C21.O=C1CSC(=O)N1 ",
"input": "",
"output": " CC(C)(C)OC(=O)N1C=COC2=CC=C(C=C3SC(=O)NC3=O)C=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CC#N.CCOC(=O)C1=CNC(S)=N1.N#CC1=CC=C(C(=O)CBr)C=C1.O=C([O-])[O-].[K+] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CCOC(=O)C1=CN=C(SCC(=O)C2=CC=C(C#N)C=C2)N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC1=CC=CC=C1.CCOC(=O)C1=CN(C)C2=CN=C(CN3CCOCC3)C=C2C1=O.ClCCl.NCC1=CC=C(Cl)C=C1.[Al+3].[Cl-] ",
"input": "",
"output": " CN1C=C(C(=O)NCC2=CC=C(Cl)C=C2)C(=O)C2=CC(CN3CCOCC3)=NC=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CC=NC=C1.CN1CCNCC1.ClCCl.O=[N+]([O-])C1=CC(S(=O)(=O)Cl)=CC=C1Cl Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CN1CCN(S(=O)(=O)C2=CC=C(Cl)C([N+](=O)[O-])=C2)CC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)C1=CC(C(=O)O)=C(OCC2=CC=CC=C2)C=C1OCC1=CC=CC=C1.CN(C)C=O.ClCCl.O=C(Cl)C(=O)Cl Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CC(C)C1=CC(C(=O)Cl)=C(OCC2=CC=CC=C2)C=C1OCC1=CC=CC=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CN(C)C=NS(=O)(=O)C1=CC=CC=C1C1=CC=C(CBr)C=C1.CN(C)C=O.O.O=C([O-])[O-].O=CC1=C(Cl)N=C(C2=CC=CC=C2)N1.[K+] ",
"input": "",
"output": " CN(C)C=NS(=O)(=O)C1=CC=CC=C1C1=CC=C(CN2C(C3=CC=CC=C3)=NC(Cl)=C2C=O)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C1CCOC1.C=C[Mg]Br.COC1=CC=C(COC2=C(Br)C=C(C=O)C=C2Br)C=C1 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: C=CC(O)C1=CC(Br)=C(OCC2=CC=C(OC)C=C2)C(Br)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC1(CI)CN2CCNC[C@H]2CO1.CCN(CC)CC.CO.[Pd] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CC1(C)CN2CCNC[C@H]2CO1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " COC1=CC=C(C(=O)O)C(CC(=O)O)=C1.NC(N)=O.O Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " COC1=CC=C2C(=O)NC(=O)CC2=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCOCC.ClC1=CC=C(OCC2=CC3=CC=CC=C3N2)C=C1.O=C(Br)CBr.O=C([O-])[O-].[Li+] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " O=C(CBr)C1=C(COC2=CC=C(Cl)C=C2)NC2=CC=CC=C12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC1(C)CC(C2CCNCC2)C(=O)N1.CCN(C(C)C)C(C)C.CN(C)C(ON1N=NC2=CC=CC=C21)=[N+](C)C.Cl.F[B-](F)(F)F.O=C(O)C1=CC=C(N2CC(F)(F)C2)C(OCC2CC2)=N1 as the reactants and reagents.",
"input": "",
"output": " CC1(C)CC(C2CCN(C(=O)C3=CC=C(N4CC(F)(F)C4)C(OCC4CC4)=N3)CC2)C(=O)N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C1CCNCC1.C=CC(=O)Cl.ClCCl .",
"input": "",
"output": " C=CC(=O)N1CCCCC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses O=C(NC(=S)NNC(=O)C1CCCO1)C1=CC(C2=CC=CC=C2)=NC2=CC=CC=C12.O=C(NNC(=S)NC(=O)C1=CC(C2=CC=CC=C2)=NC2=CC=C(OC(F)(F)F)C=C12)C1=CC=CS1 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: O=C(NC1=NN=C(C2CCCO2)O1)C1=CC(C2=CC=CC=C2)=NC2=CC=CC=C12 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC1C2=CC(Cl)=C(O)C=C2C2CNCC12.CCNC(=O)[O-].FC1=CC=CC=C1CBr as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CC1C2=CC(Cl)=C(OCC3=CC=CC=C3F)C=C2C2CNCC12 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CC(=O)OC(C)=O.O.O=C(O)C(O)C1C2=CC=CC=C2C2=C1N1C=CN=C1C(=O)N2.[Cl-].[Zn+2] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: O=C(O)C=C1C2=CC=CC=C2C2=C1N1C=CN=C1C(=O)N2 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC1=CC=C(NC(=O)C(=O)C(CC(F)(F)F)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CC2=CC=CC=C2C)NC(=O)[C@H](CCC(=O)OC(C)(C)C)NC(=O)[C@H](CC(=O)OC(C)(C)C)NC(=O)CCC(=O)OC(C)(C)C)C(C)(C)C)C(C)=C1.CC1=CC=CC=C1.O=C(O)C(F)(F)F , what product could potentially be produced?",
"input": "",
"output": "The product can be CC1=CC=C(NC(=O)C(=O)C(CC(F)(F)F)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CC2=CC=CC=C2C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)CCC(=O)O)C(C)(C)C)C(C)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC(C)(C)[Si](Cl)(Cl)Cl.CCOCC.[Li]N1CCC(C)CC1 , what product could potentially be produced?",
"input": "",
"output": "The product can be CC1CCN([Si](Cl)(Cl)C(C)(C)C)CC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C1CCOC1.CCOC(=O)C1=CN2C(C(=O)NCC34CC5CC(CC(C5)C3)C4)=CC=CC2=N1.[BH4-].[Li+] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " O=C(NCC12CC3CC(CC(C3)C1)C2)C1=CC=CC2=NC(CO)=CN12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CCCP(=O)=O.CCN(CC)CC.CNCC1=CN(C)N=C1C.Cl.ClCCl.O=C(O)C1=CN=C(SC(C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)N1C1=CC=C(F)C=C1.O=C([O-])O.[Na+] ",
"input": "",
"output": " CC1=NN(C)C=C1CN(C)C(=O)C1=CN=C(S)N1C1=CC=C(F)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.NC1=CC=C(C2=NN(C3CCCCO3)C3=CC=C(C4=NN(C(C5=CC=CC=C5)(C5=CC=CC=C5)C5=CC=CC=C5)C=N4)C=C23)C=C1.O=C(Cl)C1=CC=CC=C1 Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be O=C(CC1=CC=CC=C1)NC1=CC=C(C2=NNC3=CC=C(C4=NNC=N4)C=C23)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCN(CC)CC.CCO.COC1=CC=C(CSC2=CC(NC(N)=S)=NC=C2Br)C=C1.O=C(CBr)CCC1=CC=CC=C1 Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be COC1=CC=C(CSC2=CC(NC3=NC(CCC4=CC=CC=C4)=CS3)=NC=C2Br)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCN1CCN(C2=CC(C#N)=C3N=CN(C4=CC(C(=O)OC)=CC=C4C)C(=O)C3=C2)CC1.[Na+].[OH-] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CCN1CCN(C2=CC(C#N)=C3N=CN(C4=CC(C(=O)O)=CC=C4C)C(=O)C3=C2)CC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CC1=C(C(=O)O)N2C(=O)C(N)C2SC1.CCN(CC)CC.CN(C)C=O.Cl.ClC(C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1.ClC(Cl)Cl as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CC1=C(C(=O)O)N2C(=O)C(NC(C3=CC=CC=C3)(C3=CC=CC=C3)C3=CC=CC=C3)C2SC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC(C)(C)C1=CC=C(S(=O)(=O)Cl)C=C1.NC1=CC=C(F)C(F)=C1C(=O)C1=CC=CN=C1 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CC(C)(C)C1=CC=C(S(=O)(=O)NC2=CC=C(F)C(F)=C2C(=O)C2=CC=CN=C2)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1=CC=C([PH](C2=CC=CC=C2)(C2=CC=CC=C2)[Pd]([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)[PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.C1COCCO1.COC(=O)C1=CC=C(Br)O1.COC1=C(B2OC(C)(C)C(C)(C)O2)C=CC=C1[N+](=O)[O-].O=C([O-])[O-].[Na+] ",
"input": "",
"output": " COC(=O)C1=CC=C(C2=CC=CC([N+](=O)[O-])=C2OC)O1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1CCOC1.CC(C)N=C(NC(C)C)OC(C)(C)C.CCOC(C)=O.O=C(O)C1=NN=C(Cl)C=C1NC1=CC=C(Br)C=C1F ",
"input": "",
"output": " CC(C)(C)OC(=O)C1=NN=C(Cl)C=C1NC1=CC=C(Br)C=C1F ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CC(C)C(=O)O.CC(C)N1CCN(C(=O)[C@H]2CC[C@H](OC3=CC=C(C(=O)NN)C=C3)CC2)CC1.O=P(Cl)(Cl)Cl.[Na+].[OH-] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CC(C)C1=NN=C(C2=CC=C(O[C@H]3CC[C@H](C(=O)N4CCN(C(C)C)CC4)CC3)C=C2)O1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) Cl.O.O=C([O-])[O-].OCC1=CC=CC(O)=C1.[K+] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: O=C(O)C1=CC=C(CO)C=C1O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC(C)[C@H](N)C(=O)O.CCO.COC(=O)Cl.O.O=C([O-])[O-].[Na+].[OH-] ",
"input": "",
"output": " COC(=O)N[C@H](C(=O)O)C(C)C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)(C)OC(=O)CBr.CC1=CC=CC=C1.CCCC[N+](CCCC)(CCCC)CCCC.O=S(=O)([O-])O.OCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F.[K+].[OH-] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CC(C)(C)OC(=O)COCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CCC1=CC2=C(NC(=O)N(CCC3=CC=CC=C3)C2=O)S1.CCOC(C)=O.CN(C)C=O.ClC(Cl)(Cl)C1=NC(C2=CC=CC=C2C2=CC=C(CBr)C=C2)=NO1.O=C([O-])[O-].[K+] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CCC1=CC2=C(S1)N(CC1=CC=C(C3=CC=CC=C3C3=NOC(=O)N3)C=C1)C(=O)N(CCC1=CC=CC=C1)C2=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CCN(CC)S(F)(F)F.CS(=O)C1=CC=C([C@H]2OC(C)(C)N(C(=O)OC(C)(C)C)[C@@H]2CF)C=C1.ClCCl.Cl[Sb](Cl)Cl.O=C([O-])O.[Na+] ",
"input": "",
"output": " CC(C)(C)OC(=O)N1[C@H](CF)[C@@H](C2=CC=C(SCF)C=C2)OC1(C)C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. C1=CNC=N1.CN(C)C=O.O.O=S(=O)(NC1=CC=CC2=C1NC=C2Cl)C1=CC=C(CCCBr)C=C1 ",
"input": "",
"output": " O=S(=O)(NC1=CC=CC2=C1NC=C2Cl)C1=CC=C(CCCN2C=CN=C2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1COCCO1.CCOC(=O)CC(=O)OCC.COC1=CC(F)=C(Br)C(F)=C1.Cl.[Cu]Br.[H-].[Na+] ",
"input": "",
"output": " CCOC(=O)C(C(=O)OCC)C1=C(F)C=C(OC)C=C1F ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(=O)O.CC1=NC(N)=NN1.COC(=O)CC(=O)C(=O)OC Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " COC(=O)C1=NC2=NC(C)=NN2C(O)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CCO.COC(=O)C1=CC(CNC(=O)OC(C)(C)C)=CC=C1[N+](=O)[O-].O=C[O-].[NH4+].[Pd] ",
"input": "",
"output": " COC(=O)C1=CC(CNC(=O)OC(C)(C)C)=CC=C1N ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CS(C)=O.FC1=CC=C(Br)C=C1C(F)(F)F.O.[C-]#N.[K+].[Na+].[OH-] .",
"input": "",
"output": " O=C(O)C1=CC=C(Br)C=C1C(F)(F)F ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CCN(CC)CC.O=P(Cl)(Cl)Cl.OC1=NC=NC2=C1C1=CN=CC=C1N2 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: ClC1=NC=NC2=C1C1=CN=CC=C1N2 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CCC(C)(C)C1=CC(N=NC2=CC=CC=C2[N+](=O)[O-])=C(O)C(C(C)(C)CC)=C1.[Na+].[OH-] as the reactants and reagents.",
"input": "",
"output": " O=[N+]([O-])C1=CC=CC=C1N=NC1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CO.COC(=O)C1=CC(=O)C2=C(O1)C1=CC=CC=C1OC2.[K+].[OH-] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " O=C([O-])C1=CC(=O)C2=C(O1)C1=CC=CC=C1OC2 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1COCCO1.CCN(CC)CC.Cl.ClCCl.O=C(CNC(=O)C1=CC=C([N+](=O)[O-])C=C1[N+](=O)[O-])OCC1=CC=CC=C1.O=C(Cl)C1=CC=C([N+](=O)[O-])C(I)=C1 Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be O=C(CNC(=O)C1=CC=C([N+](=O)[O-])C(I)=C1)OCC(Cl)(Cl)Cl .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C1CCOC1.CC(C)OB(OC(C)C)OC(C)C.CCCCCC.Cl.ClC1=CC(Cl)=CC(Br)=C1.[Li]CCCC as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " OB(O)C1=CC(Cl)=CC(Cl)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " O.O=P(O)(O)C1=CC=CC=C1.[Mg+2].[OH-] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be O=P([O-])([O-])C1=CC=CC=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CSC1=C([N+](=O)[O-])CC(C)(C)CN1.N=C(N)NC1=NC(CSCCN)=CS1 Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CC1(C)CNC(NCCSCC2=CSC(NC(=N)N)=N2)=C([N+](=O)[O-])C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)N1N=CN=C1C1=NC2=C(CCOC3=CC(C4CN(CCOC5CCCCO5)C4)=CC=C32)S1.CO Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CC(C)N1N=CN=C1C1=NC2=C(CCOC3=CC(C4CN(CCO)C4)=CC=C32)S1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1=CC=C2C(=C1)C=NC1=CC=CC=C12.C1CCOC1.CCN(C(C)C)C(C)C.CCOCC.CN(C)C=O.Cl.O=C(O)C1=CC(S(=O)(=O)Cl)=CC=C1O.[Li]C as the reactants and reagents.",
"input": "",
"output": " CC1C2=CC=CC=C2C2=CC=CC=C2N1S(=O)(=O)C1=CC=C(O)C(C(=O)O)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CN(C)C=O.COC(=O)C1=CC([N+](=O)[O-])=C(OC2=CC=CN=C2)C(S(=O)(=O)N=CN(C)C)=C1.[Ni] ",
"input": "",
"output": " COC(=O)C1=CC(N)=C(OC2=CC=CN=C2)C(S(=O)(=O)N=CN(C)C)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) COC1=CC=C2CC(N)COC2=C1.COC1=CC=C2OCC(N)CC2=C1.COC1=CC=C2SCC(N)CC2=C1.COC1=CC=CC2=C1CC(N)CS2.COC1=CC=CC2=C1OCC(N)C2 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CCCN(CCNC(=O)C(C)C)C1CCC2=C(OC)C=CC=C2O1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using COP(=O)(CC(=O)C(C)(C)C)OC.NN.O.O=C1C(=O)C2CCC1CC2 as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CC(C)(C)C1=CC2=C(N=N1)C1CCC2CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C1=CC=NC=C1.CCOC(C)=O.COC(=O)C(=O)CC1=CC=CC(C(F)(F)F)=C1.COCC1=NNC(N)=C1C1=CC=C(OC)C=C1 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: COCC1=NN2C(C3=CC=CC(C(F)(F)F)=C3)=CC(=O)NC2=C1C1=CC=C(C)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " COC1=CN=C(OC2=CC=CC=C2)C(N)=N1.COC1=CN=C(OC2=CC=CC=C2)C(O)=N1.O=N[O-].O=P(Cl)(Cl)Cl.[Na+] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be COC1=CN=C(OC2=CC=CC=C2)C(Cl)=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CN(C)C=O.O=C(NC1=CC=C(SC2=CC=C(C(=O)O)C=C2[N+](=O)[O-])C=C1)OCC(Cl)(Cl)Cl.O=S(Cl)Cl .",
"input": "",
"output": " O=C(NC1=CC=C(SC2=CC=C(C(=O)Cl)C=C2[N+](=O)[O-])C=C1)OCC(Cl)(Cl)Cl ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CCOC(C)=O.CN(C)C=O.CSC1=CC=CC(C(=O)NC2=CC=C(N3C(=O)CC(=O)NC4=C3C=CC3=CC=CC=C43)C=C2)=C1.O=C(OO)C1=CC=CC(Cl)=C1 ",
"input": "",
"output": " CS(=O)C1=CC=CC(C(=O)NC2=CC=C(N3C(=O)CC(=O)NC4=C3C=CC3=CC=CC=C43)C=C2)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CC=C(P(C2=CC=CC=C2)[C-]2C=CC=C2)C=C1.C1CCOC1.CC1=CC=CO1.CCC(CC)C1=CC(C)=NN2C(C3=C(C)C=C(Br)S3)=C(C)N=C12.CCCCCC.CCOC(C)=O.CCOCC.Cl[Pd]Cl.[Cl-].[Fe+2].[Li]C(C)(C)C.[Zn+2] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CCC(CC)C1=CC(C)=NN2C(C3=C(C)C=C(C4=CC=C(C)O4)S3)=C(C)N=C12 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if Br.CC[C@@]1(O)C(=O)OCC2=C1C=C1C3=NC4=CC=CC(N)=C4C=C3CN1C2=O.O.O=N[O-].[Na+] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC[C@@]1(O)C(=O)OCC2=C1C=C1C3=NC4=CC=CC(Br)=C4C=C3CN1C2=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.CC1=CC=CC=C1S(=O)(=O)Cl.C[C@@H](O)C1=CC=NC=C1.O.[Li]CCCC.[N-]=[N+]=[N-].[Na+] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " C[C@H](N=[N+]=[N-])C1=CC=NC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C1=CC=C([PH](C2=CC=CC=C2)(C2=CC=CC=C2)[Pd]([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)[PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.CC1(C)OB(C2=CNN=C2)OC1(C)C.CC1=CC(C2=CC=C(CC(=O)NC3=CC=C(I)C=N3)C=C2)=CC=N1.CC1=CC=CC=C1.CCO.O=C([O-])[O-].[Na+] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC1=CC(C2=CC=C(CC(=O)NC3=CC=C(C4=CNN=C4)C=N3)C=C2)=CC=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CCN=C=NCCCN(C)C.CN(C)C=O.NC1=CNN=C1C(=O)NC1=CC=C(F)C=C1.ON1N=NC2=CC=CC=C21 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " O=C1CCC(C(=O)NC2=CNN=C2C(=O)NC2=CC=C(F)C=C2)N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(=O)O.Cl.Cl[Sn]Cl.O.O=[N+]([O-])C1=CC=C(C2=NC3=CC(Cl)=CC=C3N2)C=C1 Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " NC1=CC=C(C2=NC3=CC(Cl)=CC=C3N2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C1CCOC1.C=CC(C)(C)OC(C)=O.CC(C)Cl.CCOC(=O)CC#N.CCOCC.[Cl-].[H-].[MgH2].[NH4+].[Na+] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: C=CC(C)(C)C(C#N)C(=O)OCC .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.CCCCOCCOC1=CC=C(C2=CC=C3C(=C2)C=C(C(=O)O)CCCN3CCC)C=C1.CCN(CC)CC.CN(C)C=O.CN(CC1=CC=C(N)C=C1)C1CCOCC1.O.O=S(Cl)Cl Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CCCCOCCOC1=CC=C(C2=CC=C3C(=C2)C=C(C(=O)NC2=CC=C(CN(C)C4CCOCC4)C=C2)CCCN3CCC)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CN(C)C=O.Cl.ClC1=CC=CC=C1.O=C(O)C1=CC=CC=C1F.O=S(Cl)Cl.[Al+3].[Cl-] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be O=C(C1=CC=C(Cl)C=C1)C1=CC=CC=C1F .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CC(C)(C)O.COC(=O)CC1=CC=CC=C1NCC(=O)OC(C)(C)C.ClCCl.O.O=C=NS(=O)(=O)Cl as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: COC(=O)CC1=CC=CC=C1N(CC(=O)OC(C)(C)C)S(=O)(=O)NC(=O)OC(C)(C)C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC1=CN=C(N2CCN(C(=O)C3=CC=C(I)C=C3C)CC2)C(C)=C1.O=S1(=O)CCCN1 .",
"input": "",
"output": " CC1=CN=C(N2CCN(C(=O)C3=CC=C(N4CCCS4(=O)=O)C=C3C)CC2)C(C)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C1COCCO1.CC1=CC=CC=C1.C[C@@H]1C[C@H]1C(=O)NC1=CC=C(CN)C=C1.O=C(N1CCC2=CC=C(Cl)C(OS(=O)(=O)C(F)(F)F)=C2CC1)C(F)(F)F as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " C[C@@H]1C[C@H]1C(=O)NC1=CC=C(CNC2=C(Cl)C=CC3=C2CCN(C(=O)C(F)(F)F)CC3)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: COCC(C)(C)C(N)=NO.N#CC1CCN(C(=O)N2CC(C(=O)O)CC(C3=CC=C(C(F)(F)F)C=C3)C2)CC1 .",
"input": "",
"output": " COCC(C)(C)C1=NOC(C2CC(C3=CC=C(C(F)(F)F)C=C3)CN(C(=O)N3CCC(C#N)CC3)C2)=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCOC(=O)Cl.O=C(NCC1CNCCO1)C1=CNC2=C(C3=C4OCOC4=CC=C3OCC3CC3)N=CN=C12 Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CCOC(=O)N1CCOC(CNC(=O)C2=CNC3=C(C4=C5OCOC5=CC=C4OCC4CC4)N=CN=C23)C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CC=C(COC2=CC=C3C(=C2)CCNC3C2=CC=C(OCCN3CCCC3)C=C2)C=C1.CO.O=C[O-].[NH4+].[OH-].[Pd+2] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be OC1=CC=C2C(=C1)CCNC2C1=CC=C(OCCN2CCCC2)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C=CCOC(=O)N1CCC[C@@H](C)[C@H]1CNC1=NC2=CC(Cl)=CC=C2O1.CC1=CC=C(N2N=CC(C)=N2)C(C(=O)N2CCC[C@@H](C)[C@H]2CN)=C1 ",
"input": "",
"output": " CC1=CC=C(N2N=CC(C)=N2)C(C(=O)N2CCC[C@@H](C)[C@H]2CNC2=NC3=CC(Cl)=CC=C3O2)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CO.COC(=O)C1=CN(C(=O)OC(C)(C)C)C2=NC=CC(CN[C@H](CC(C)C)C(=O)N3CCCC3)=C12.[Na+].[OH-] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CC(C)C[C@@H](NCC1=CC=NC2=C1C(C(=O)O)=CN2)C(=O)N1CCCC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1CCOC1.CC1=NC(Br)=CC(Br)=C1O.[Li]CCCC as the reactants and reagents.",
"input": "",
"output": " CC1=NC(Br)=CC=C1O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC1=CC=C(S(=O)(=O)O)C=C1.CN(C)S(=O)(=O)C1=CC2=C(OCC2)C(C(C)(C)CC2(C(F)(F)F)COC(C)(C)O2)=C1.CO.O.O=C([O-])O.[Na+] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CN(C)S(=O)(=O)C1=CC2=C(OCC2)C(C(C)(C)CC(O)(CO)C(F)(F)F)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1CCOC1.CC(=O)O.CCCC(C)CC(=O)OC.COP(C)(=O)OC.O.[Li]CCCC as the reactants and reagents.",
"input": "",
"output": " CCC[C@H](C)CC(=O)CP(=O)(OC)OC ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC(=O)N(C)C.CC1=CC=C(S(=O)(=O)[O-])C=C1CCCl.NS(=O)(=O)C1=NC=CC=C1O.O=C([O-])[O-].[K+] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: NS(=O)(=O)C1=NC=CC=C1OCCCl .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CC=CCC#N.CO.OC1CCCCC1 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: N#CCCCCC(=O)OC1CCCCC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC(=O)O.CC(=O)O[BH-](OC(C)=O)OC(C)=O.CCC[C@H](N)C(=O)NC1=NC=C(C(C)C)S1.CCOC(C)=O.ClCCl.O=C1CCC2=C(F)C=C(F)C=C2C1.[Na+] , what product could potentially be produced?",
"input": "",
"output": "The product can be CCC[C@H](NC1CCC2=C(F)C=C(F)C=C2C1)C(=O)NC1=NC=C(C(C)C)S1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. BrCC1=CC=CC=C1.CC(C)=O.Cl.O=C(C=CC1=CC=CN=C1)NCCCCC1CCNCC1.O=C([O-])[O-].[K+] ",
"input": "",
"output": " O=C(C=CC1=CC=CN=C1)NCCCCC1CCN(CC2=CC=CC=C2)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1CCOC1.CC(C)(C)C1CC2=C(Br)C=CC=C2C1=O.CO.Cl.[BH4-].[Na+] ",
"input": "",
"output": " CC(C)(C)C1CC2=C(Br)C=CC=C2C1O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC(C)O.C[C@@]1(NCC2=CC=CC=C2)CC[C@@H]2CN(C3=CC=CC(C(F)(F)F)=N3)C[C@@H]21.[H][H] ",
"input": "",
"output": " C[C@@]1(N)CC[C@@H]2CN(C3=CC=CC(C(F)(F)F)=N3)C[C@@H]21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CCOC(C)=O.C[O-].O=C1OCC2=CC=CC=C12.O=CC1=CC=CC=C1C(=O)O.[Na+] ",
"input": "",
"output": " O=C1C2=CC=CC=C2C2=C1C1=CC=CC=C1C(=O)O2 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CC1=CC=C(S(=O)(=O)O)C=C1.CC1=CC=CC=C1.C[C@@H](O)CN.O.O=CCC1CC2=CC(F)=CC=C2C1=O as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " C[C@@H](O)CN1C=CC2=C1C1=CC=C(F)C=C1C2 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC(O)CN.CC1=CC=C(S(=O)(=O)O)C=C1.CC1=CC=CC=C1.O.O=CCC1CC2=CC(F)=CC=C2C1=O ",
"input": "",
"output": " CC(O)CN1C=CC2=C1C1=CC=C(F)C=C1C2 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)(C)OC(=O)N1CCC(N2C=C(B3OC(C)(C)C(C)(C)O3)C=N2)CC1.COC(=O)N1C2=CC=C(Br)C(OC3CCC3)=C2CC[C@@H]1C Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be COC(=O)N1C2=CC=C(C3=CN(C4CCN(C)CC4)N=C3)C(OC3CCC3)=C2CC[C@@H]1C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC(C)(C)C([O-])([O-])[O-].CCS(=O)(=O)O.CN(C)C=O.NC1=NC(Cl)=C(N)C(N[C@H]2C=C[C@@H](CO)C2)=N1 ",
"input": "",
"output": " CC1=NC2=C(Cl)N=C(N)N=C2N1[C@H]1C=C[C@@H](CO)C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CCC1=CC2=C(C=N1)NN=C2.NC(=O)C1=NN(CC(=O)O)C2=CN=CC=C12 as the reactants and reagents.",
"input": "",
"output": " CCC1=CC2=C(C=N1)N(CC(=O)O)N=C2C(N)=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. C1CCOC1.CC(C)(C)OC(=O)N1C=CC2=CC(C3(C)OCCO3)=CC=C21.CC(C)OB(OC(C)C)OC(C)C.CC(C)[N-]C(C)C.[Li+] ",
"input": "",
"output": " CC(=O)C1=CC=C2C(=C1)C=C(C)N2C(=O)OC(C)(C)C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC(C)CN1C(N)=CC(=O)N(C)C1=S.CCO.Cl.O.O=N[O-].[Na+] ",
"input": "",
"output": " CC(C)CN1C(N)=C(N=O)C(=O)N(C)C1=S ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CCOC(=O)C1=CC=CN2C=C(C(C)C)N=C12.[Br-].[K+] ",
"input": "",
"output": " CC(C)C1=CN2C=CC=C(CO)C2=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1COCCO1.CO.COCN(C1=CC(Cl)=CN=C1C(=O)C1=CC=CC2=C1N(C)C(=O)N2)S(=O)(=O)C1=CC=C(C)C(C(F)(F)F)=C1.Cl.O ",
"input": "",
"output": " CC1=CC=C(S(=O)(=O)NC2=CC(Cl)=CN=C2C(=O)C2=CC=CC3=C2N(C)C(=O)N3)C=C1C(F)(F)F ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CC(=O)O.CCOC(=O)C[N+](=O)[O-].CCOC(OCC)OCC.NC1=CC=CC2=CC=CN=C12.[Fe] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CCOC(=O)C1=CN(C2=CC=CC3=CC=CN=C23)C=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC1=CC=C(S(=O)(=O)O)C=C1.CC1=CC=CC=C1C.NC1=CC=C(Cl)C=C1.O=C1C2=CC=CC=C2C(O)N1CCCN1CC=C(C2=CC=CC=C2)CC1 ",
"input": "",
"output": " O=C1C2=CC=CC=C2C(NC2=CC=C(Cl)C=C2)N1CCCN1CC=C(C2=CC=CC=C2)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC(=O)O[C@@H](C)C(=O)Cl.CC1=C(C(=O)N[C@H]2CC[C@H](N)CC2)C2=NC=NC(C3=C4OCOC4=CC=C3OCC3CC3)=C2N1.Cl as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CC1=C(C(=O)N[C@H]2CC[C@H](NC(=O)[C@H](C)O)CC2)C2=NC=NC(C3=C4OCOC4=CC=C3OCC3CC3)=C2N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(=O)O[C@@H](C)C(=O)Cl.CC1=C(C(=O)N[C@H]2CC[C@@H](N)CC2)C2=NC=NC(C3=C4OCOC4=CC=C3OCC3CC3)=C2N1.Cl Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CC1=C(C(=O)N[C@H]2CC[C@@H](NC(=O)[C@H](C)O)CC2)C2=NC=NC(C3=C4OCOC4=CC=C3OCC3CC3)=C2N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(=O)N(C)C1=CC(C(=O)C=CN(C)C)=CC=C1F.CC(=O)O.CCOC(C)=O.NC1=C(C(=O)C2=CC=CS2)C=NN1 Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CC(=O)N(C)C1=CC(C2=CC=NC3=C(C(=O)C4=CC=CS4)C=NN23)=CC=C1F .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C1CCOC1.COC1=CC=CC=C1.O=[N+]([O-])C1=CC=C2OC3=C([N+](=O)[O-])C=CC=C3OC2=C1.[H][H].[Pd] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: NC1=CC=C2OC3=C(N)C=CC=C3OC2=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC(=O)Cl.O=C[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO.OCC1=CC=CC=C1 , what product could potentially be produced?",
"input": "",
"output": "The product can be OC[C@H]1O[C@H](OCC2=CC=CC=C2)[C@H](O)[C@@H](O)[C@@H]1O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " BrBr.C=CC(F)=C(F)F.CO.O=C([O-])[O-].[K+] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be COC(F)(F)/C(F)=C/CBr .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CC(=O)OCCBr.CC(C)=O.CCOCC.O=C([O-])[O-].O=CC1=CC=C(O)C(Cl)=C1.[K+] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CC(=O)OCCOC1=CC=C(C=O)C=C1Cl .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CCCCOC(=O)C1=NC(Br)=C2C=CC=CC2=C1O.CCOC(C)=O.NC1=CC=CC=C1 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CCCCOC(=O)C1=NC(NC2=CC=CC=C2)=C2C=CC=CC2=C1O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CCN(CC)CC.CCOCC.Cl.ClCCCl.O=C(O)C1=NN(C2=CC=CC=C2Cl)C(C2=CC=C(Cl)C=C2)=C1OCCNCC(F)(F)F as the reactants and reagents.",
"input": "",
"output": " O=C1C2=NN(C3=CC=CC=C3Cl)C(C3=CC=C(Cl)C=C3)=C2OCCN1CC(F)(F)F ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C1CCOC1.CC(=O)N(C)C.CCN(CC)CC.COC1=CC=C(N2C[C@@H]3CC[C@H]2CNC3=O)C=C1.FC1=CC=C2N=C(Cl)N=CC2=C1.[Al+3].[H-].[Li+] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: COC1=CC=C(N2C[C@@H]3CC[C@H]2CN(C2=NC=C4C=C(F)C=CC4=N2)C3)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC(C)(C)OC(=O)N1CCC(NCC2=CC=CC=C2)C(O)C1.CC(C)(C)OC(=O)N1CCC(O)C(NCC2=CC=CC=C2)C1.CCN(CC)CC.ClCCl.O=C(Cl)CCl is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC(C)(C)OC(=O)N1CCC(N(CC2=CC=CC=C2)C(=O)CCl)C(O)C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC(C)(C)OC(=O)NC1=CC=C(N)C=C1.O=[N+]([O-])C1=C(OS(=O)(=O)C(F)(F)F)C=CC2=CN=CC=C12 ",
"input": "",
"output": " CC(C)(C)OC(=O)NC1=CC=C(NC2=CC=C3C=NC=CC3=C2[N+](=O)[O-])C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1CCOC1.CC#CC(=O)OCC.CC1=CC=CC=C1.CCCCP(CCCC)CCCC.COC1=CC=C(P2(=S)SP(=S)(C3=CC=C(OC)C=C3)S2)C=C1.CS(=O)(=O)C1=CC=C(OC2=CC(OCC3CCOCC3)=C3NC(C(N)=O)=CC3=C2)C=C1 ",
"input": "",
"output": " CCOC(=O)CC1CN=C(C2=CC3=CC(OC4=CC=C(S(C)(=O)=O)C=C4)=CC(OCC4CCOCC4)=C3N2)S1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CCCCCC(=O)Cl.CN1CCC(C2=CNC3=CC=C(N)N=C23)CC1 ",
"input": "",
"output": " CCCCCC(=O)NC1=CC=C2NC=C(C3CCN(C)CC3)C2=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)OC(C)C.CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(=NOCC(=O)OC(C)(C)C)C3=CSC=N3)[C@H]2SC1.CCCCCC.COC1=CC=CC=C1.ClCCl Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(=NOCC(=O)O)C3=CSC=N3)[C@H]2SC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C#C[Si](C)(C)C.CC(C)(C)O.O.O=C([O-])O.O=C1O[C@H]([C@@H](O)CO)C([O-])=C1O.[N-]=[N+]=NC1=CC=CC(Cl)=N1.[Na+] , what product could potentially be produced?",
"input": "",
"output": "The product can be C[Si](C)(C)C1=CN(C2=CC=CC(Cl)=N2)N=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CCCC[C@@H](NC1=CC(C)=C(F)C(C)=C1)C(=O)NOC(C)(C)C.ClCCl.O=C(O)C(F)(F)F as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CCCCC(NC1=CC(C)=C(F)C(C)=C1)C(=O)NO ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CN(C)C=O.ClCC1=CC=CN=C1.N#CC(C#N)CCC(F)(F)F.O.O=C([O-])[O-].[K+] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " N#CC(C#N)(CCC(F)(F)F)CC1=CC=CN=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)(C)OC(=O)NCCC(O)C1=CC=CC(N)=C1.O=C1CCC(C(=O)O)CN1 Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CC(C)(C)OC(=O)NCCC(O)C1=CC=CC(NC(=O)C2CCC(=O)NC2)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C=CCNC1=CC=CC=C1CC(=O)OC.CC1=CC=C(S(=O)(=O)O)C=C1.OCCCO Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be C=CCNC1=CC=CC=C1CC(=O)OCCCO .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC(=O)O[C@H](CC(=O)NC1=CC=C(C2=NOC=C2NC(=O)OC(C)C2=CC=CC=C2Cl)C=C1)C(=O)O.CO.Cl.[Na+].[OH-] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CC(OC(=O)NC1=CON=C1C1=CC=C(NC(=O)C[C@@H](O)C(=O)O)C=C1)C1=CC=CC=C1Cl .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C1CCOC1.CC(C)(C)ON=O.N#CC1CCC2=C1SC(N)=N2 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: N#CC1CCC2=C1SC=N2 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C1=CNC=N1.C1CCOC1.CC(C)(C)[Si](C)(C)Cl.CCOCC.CCOP(=O)(CCC(O)CO)OCC .",
"input": "",
"output": " CCOP(=O)(CCC(O)CO[Si](C)(C)C(C)(C)C)OCC ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC1=C(Br)C=CC=C1C(=O)O.O=C1CCC(=O)N1I.O=S(=O)(O)O Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CC1=C(Br)C=C(I)C=C1C(=O)O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC(=O)C1=CC=CC(S)=C1.CI.CN(C)C=O.O.O=C([O-])[O-].[K+] as the reactants and reagents.",
"input": "",
"output": " CSC1=CC=CC(C(C)=O)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC(C)(C#N)N=NC(C)(C)C#N.CO/C=C(/C(=O)OC)C1=CC=C(Cl)C=C1C.ClC(Cl)(Cl)Cl.O=C1CCC(=O)N1Br as the reactants and reagents.",
"input": "",
"output": " CO/C=C(/C(=O)OC)C1=CC=C(Cl)C=C1CBr ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CCN(C(=O)CCNCC(F)F)C1=CN(C2=CC=CN=C2)N=C1Cl.CN(C)C1=CC=NC=C1.ClCCl.O=C(O)C1CC1(F)F as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CCN(C(=O)CCN(CC(F)F)C(=O)C1CC1(F)F)C1=CN(C2=CC=CN=C2)N=C1Cl .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if O=C1N(CCN2CCC(C3=NOC4=CC(F)=CC=C34)CC2)CCN1C1=CC=CC=C1.O=C=NC1=CC=C(O)C=C1 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " O=C1N(CCN2CCC(C3=NOC4=CC(F)=CC=C34)CC2)CCN1C1=CC=C(O)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC(C)(C)OC(=O)NC1=CC=C(C(=O)C2=CC=CC=C2)C=C1NC(=O)CC(=O)C1=CC=CC(Cl)=C1.ClCCl.O=C(O)C(F)(F)F as the reactants and reagents.",
"input": "",
"output": " O=C1CC(C2=CC=CC(Cl)=C2)=NC2=CC=C(C(=O)C3=CC=CC=C3)C=C2N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCCCC(Br)C(=O)C1=CC=CC=C1.O=CO.O=C[O-].[NH4+].[Na+].[OH-] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CCCCC1=C(C2=CC=CC=C2)N=CO1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1=CC=CC=C1.CC(=O)C(=NO)C(=O)OC(C)(C)C.CC(=O)O.NC1=CC=CC=C1.O ",
"input": "",
"output": " CC(=NC1=CC=CC=C1)C(=NO)C(=O)OC(C)(C)C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C=C(O[Si](C(C)C)(C(C)C)C(C)C)C(F)F.CC[Zn]CC.ClCCl.ICI.O=C(O)C(F)(F)F .",
"input": "",
"output": " CC(C)[Si](OC1(C(F)F)CC1)(C(C)C)C(C)C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC(C)(C)OC(=O)N1CCC(OC2=CC(N3CCC4=CC(S(C)(=O)=O)=CC=C43)=NC=N2)CC1.CCCCS(=O)(=O)Cl.CCN(C(C)C)C(C)C.ClCCl.O=C(O)C(F)(F)F , what product could potentially be produced?",
"input": "",
"output": "The product can be CCCCS(=O)(=O)N1CCC(OC2=CC(N3CCC4=CC(S(C)(=O)=O)=CC=C43)=NC=N2)CC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C1CCOC1.CC1(C)CCCC(=O)N1.CC1(C)CCCNC1=O.CI.[H-].[Na+] .",
"input": "",
"output": " CN1C(=O)CCCC1(C)C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C1CCOC1.COC(=O)CN1C(=O)[C@@H](C)N(C)CC1C1=CC=CC=C1.Cl.[Li+].[OH-] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: C[C@@H]1C(=O)N(CC(=O)[O-])C(C2=CC=CC=C2)CN1C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. C1=CC([Mg]C2C=CC=C2)C=C1.C1CCOC1.ClCCl.[Cl-].[Ti+3] ",
"input": "",
"output": " C1=CC([Ti+2]C2C=CC=C2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if COC(=O)C(OC)C(=O)[O-].ClCCl.O=S(Cl)Cl is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " COC(=O)COCC(=O)Cl ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC1=CC=CC=C1.CC1COC(CBr)OC1C.CCN(CC)CC.CCOC(CCN)OCC ",
"input": "",
"output": " CCOC(CCNCC1OCC(C)C(C)O1)OCC ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC(C)(C)[O-].CCOC(=O)CC(=O)NC1=CC(Cl)=CC=C1[N+](=O)[O-].CN(C)C=O.Cl.O.[K+] ",
"input": "",
"output": " CCOC(=O)C1=C(O)N=C2C=C(Cl)C=CC2=[N+]1[O-] ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: O=C1CCCC(C[N+](=O)[O-])C1.[Al+3].[H-].[Li+] , what product could potentially be produced?",
"input": "",
"output": "The product can be NCC1CCCC(O)C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C#CCO.CC(C)C1(C)C(=O)N=C2C3=CC=CC=C3C(=O)N21.Cl.ClCCl.[H-].[Na+].[NaH] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be C#CCOC(=O)C1=CC=CC=C1C1=NC(=O)C(C)(C(C)C)N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C1CCOC1.CC1=CC=CC=C1.CCOC(=O)CC(=O)C1=CC=NC=N1.CCOC(=O)N1CCN=C(N)C(N2C(=O)C3=CC=CC=C3C2=O)C1.Cl.[H-].[Na+] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CCOC(=O)N1CCN2C(=NC(C3=CC=NC=N3)=CC2=O)C(N2C(=O)C3=CC=CC=C3C2=O)C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: COC(=O)CCC1=NC(C(C)C)=C(SC2=CC(F)=CC(F)=C2)N1CC1=CC=CC=N1.COC1=CC=C(COCC2=NC(C(C)C)=C(SC3=CC=CC(Cl)=C3)N2)C=C1 , what product could potentially be produced?",
"input": "",
"output": "The product can be CC(C)C1=C(SC2=CC=CC(Cl)=C2)N(C)C(CO)=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. C1CCOC1.CCOCC.C[C@@H]1O[C@@H]1C.C[C@H](N)C1=CC=CC=C1.[Br-].[Cl-].[Mg+2].[NH4+] ",
"input": "",
"output": " CC(NC(C)C(C)O)C1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1CCOC1.CCC1=CC(C(=O)OC)=CC=C1F.CO.O.[Li+].[OH-].[Pd] ",
"input": "",
"output": " CCC1=CC(C(=O)O)=CC=C1F ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC(=O)OC1=CC=C(Br)C=C1C.CCC1=CC(Br)=CN=C1C(=O)O.CC[Mg]Br.COC(=O)C1=CC=CC(Br)=C1.ClCCl as the reactants and reagents.",
"input": "",
"output": " CCC(O)(CC)C1=CC=C(Br)C=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.CCCC[N+](CCCC)(CCCC)CCCC.COC(=O)CCl.Cl.O.O=C([O-])[O-].O=CC1=CC=C([N+](=O)[O-])C=C1O.[I-].[K+].[OH-] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be O=C(O)C1=CC2=CC=C([N+](=O)[O-])C=C2O1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC1=CC=C(S(=O)(=O)OCCF)C=C1.CCN(CC)C(=O)C1SC2=CC=CC=C2C2=C1C1=CC(OC)=CC=C1N2.CN(C)C=O.[H-].[Na+] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CCN(CC)C(=O)C1SC2=CC=CC=C2C2=C1C1=CC(OC)=CC=C1N2CCF ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1COCCO1.CC(=O)C1=CC=C2CCN(C(=O)OC(C)(C)C)CCC2=C1.CCO.NCCN.O.O=[Se]=O.[K+].[OH-] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CC(C)(C)OC(=O)N1CCC2=CC=C(C3=CN=CC=N3)C=C2CC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1=CC=C(P(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.C1CCOC1.CC(C)(C)OC(=O)N=NC(=O)OC(C)(C)C.CCOC(=O)[C@H]1C[C@@H]1C1=CC=C(O)C=C1.O[C@H]1CCC2=C(Br)C=CC(F)=C21 ",
"input": "",
"output": " CCOC(=O)[C@H]1C[C@@H]1C1=CC=C(O[C@@H]2CCC3=C(Br)C=CC(F)=C32)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CCN(C(C)C)C(C)C.ClCCl.N=C(N)C1CCCCC1.SC(Cl)(Cl)Cl is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " ClC1=NC(C2CCCCC2)=NS1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C1CCOC1.CC#N.CCOC(=O)C(C)(C)OC1=CC=C(NC2=CC(Cl)=NN(C)C2=O)N=C1.O=C=O.[Al+3].[H-].[Li+] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CN1N=C(Cl)C=C(NC2=CC=C(OC(C)(C)CO)C=N2)C1=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCOCC.COC(=O)C(CC1=CC=NC=C1)(CC1=CC=NC=C1)C(=O)NC12CC3CC(CC(C3)C1)C2.C[Mg]Br Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CC(=O)C(CC1=CC=NC=C1)(CC1=CC=NC=C1)C(=O)NC12CC3CC(CC(C3)C1)C2 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1=CC=CC=C1.CC(C)(C#N)N=NC(C)(C)C#N.CC1=C(C#N)C(C2=CC=CC=C2Cl)C2=CN(C(=O)OC(C)(C)C)N=C2N1.O=C1CCC(=O)N1Br as the reactants and reagents.",
"input": "",
"output": " CC(C)(C)OC(=O)N1C=C2C(=N1)NC(CBr)=C(C#N)C2C1=CC=CC=C1Cl ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C=C(C)C(=O)O.CC1=CC=C(S(=O)(=O)O)C=C1.CC1=CC=CC=C1.COC1=CC(C2=NC3=CC=CC=C3S2)=CC(OC)=C1OCCCCCCO.OC1=CC=C(O)C=C1 ",
"input": "",
"output": " C=C(C)C(=O)OCCCCCCOC1=C(OC)C=C(C2=NC3=CC=CC=C3S2)C=C1OC ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC(C)=O.CCCCCCCCCCCC(=O)O.NC(CCC(=O)O)C(=O)O.N[C@@H](CCC(=O)[O-])C(=O)[O-].O.O=S(=O)(O)O.[Na+].[OH-] ",
"input": "",
"output": " CCCCCCCCCCCC(=O)NC(CCC(=O)O)C(=O)O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.COC1=CC=C2C(=C1)C(=O)OC(=O)N2C.N Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CNC1=CC=C(OC)C=C1C(N)=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. C1COCCO1.C=CS(C)(=O)=O.COC1=CC(N2CCNCC2)=CC=C1[N+](=O)[O-] ",
"input": "",
"output": " COC1=CC(N2CCN(CCS(C)(=O)=O)CC2)=CC=C1[N+](=O)[O-] ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC(=O)NN.CCN(CC)CC.COC1=CC(OC2=CC=C(N)C=C2)=CC=C1C.ClCCl.O=C(OC(Cl)(Cl)Cl)OC(Cl)(Cl)Cl ",
"input": "",
"output": " COC1=CC(OC2=CC=C(N3C(C)=NNC3=O)C=C2)=CC=C1C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC(C)(C)N.CC1=NC2=C(C#N)C(C)=NN2C(Cl)=C1CCCl.CCC(C)=O.CCN(CC)CC.CCO.O=C([O-])[O-].[Br-].[K+].[Na+] ",
"input": "",
"output": " CC1=NC2=C(C#N)C=NN2C2=C1CCN2C(C)(C)C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1CCOC1.CC1=NOC(C)=C1C1=CC(N)=C(NC2CC2)C(I)=C1.O=C(N1C=CN=C1)N1C=CN=C1 ",
"input": "",
"output": " CC1=NOC(C)=C1C1=CC(I)=C2C(=C1)NC(=O)N2C1CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC(C)(C)P(C(C)(C)C)C(C)(C)C.CCOC(C)=O.CN1CCCC1CCN1C(C2=CC=C([N+](=O)[O-])C=C2)=CC2=CC(Br)=CC=C21.C[Si](C)(C)[N-][Si](C)(C)C.O.O=C(C=CC1=CC=CC=C1)C=CC1=CC=CC=C1.[Li+].[Na+].[OH-].[Pd] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CN1CCCC1CCN1C(C2=CC=C([N+](=O)[O-])C=C2)=CC2=CC(N)=CC=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1COCCN1.CC(=O)N1CCC(=O)CC1.CC1=CC=C(S(=O)(=O)O)C=C1.CC1=CC=CC=C1.O Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CC(=O)N1CC=C(N2CCOCC2)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C1CCOC1.CC(C)(C)[Si](C)(C)OC1=CC=CC(O)=C1F.CCOCC.O.O=C=O.[Li]C(C)CC as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CC(C)(C)[Si](C)(C)OC1=CC=CC(C(=O)O)=C1F ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC(C)(C)OC(=O)NCCCCNC(=O)C1=CC=C(NC2=NC(NCC3=CC=C(OCCBr)C=C3)=NC(OCC(F)(F)F)=N2)C=C1.ClCCl.O=C(O)C(F)(F)F ",
"input": "",
"output": " NCCCCNC(=O)C1=CC=C(NC2=NC(NCC3=CC=C(OCCBr)C=C3)=NC(OCC(F)(F)F)=N2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C#CCCC1=NC2=CC=CC=C2S1.FCC1=CC=CC(Br)=N1 Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " FCC1=CC=CC(C#CCCC2=NC3=CC=CC=C3S2)=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC1=CC=C(S(=O)(=O)O)C=C1.CCOC(C)=O.CC[C@@H](NC(=O)OC(C)(C)C)[C@H]1CC[C@@H](C)O1.ClCCl.O=C(O)C(F)(F)F as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CC[C@@H](N)[C@H]1CC[C@@H](C)O1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CO.FC1=CN=C(Cl)N=C1Cl.NC1=CC=C(CCCF)C=C1.O as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: FCCCC1=CC=C(NC2=NC(Cl)=NC=C2F)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)(C#N)N=NC(C)(C)C#N.COC(=O)C1=C(C)C2=CC=CC=C2O1.ClC(Cl)(Cl)Cl.O=C1CCC(=O)N1Br Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be COC(=O)C1=C(CBr)C2=CC=CC=C2O1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC(=O)O.CC(=O)O[BH-](OC(C)=O)OC(C)=O.CCCN1C(=O)C2=C(N=C(C34CCCC(C=O)(CCC3)C4)N2)N(CCC)C1=O.CCOC(C)=O.CN(C)CCN.ClCCl.[Na+] .",
"input": "",
"output": " CCCN1C(=O)C2=C(N=C(C34CCCC(CNCCN(C)C)(CCC3)C4)N2)N(CCC)C1=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C1CCOC1.CC(C)[Mg]Cl.O=C1C(=O)N(C(C2=CC=CC=C2)C2=CC=CC=C2)C2=C(Cl)C=CC=C12.OC1=CC=C2CCOC2=C1 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " O=C1N(C(C2=CC=CC=C2)C2=CC=CC=C2)C2=C(Cl)C=CC=C2C1(O)C1=CC2=C(C=C1O)OCC2 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CO.COC1=CC(Br)=CC=C1CC#N.O.[Na+].[OH-] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: COC1=CC(Br)=CC=C1CC(=O)O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)C[C@H](NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)CNC(=O)OC(C)(C)C)C(=O)O.CCN(C(C)C)C(C)C.CN(C)C=O.CN(C)[P+](ON1N=NC2=CC=CC=C21)(N(C)C)N(C)C Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CC(C)C[C@H](NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)CN)C(=O)O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. COC(=O)N1CCC2=NN=C(Cl)C=C2C1.NN.O ",
"input": "",
"output": " COC(=O)N1CCC2=NN=C(NN)C=C2C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC1=CC=CC(OCCCC(=O)N2CCCC3=C(C4=CC=C(COC(=O)OC5=CC=C([N+](=O)[O-])C=C5)C=C4)C=CC=C32)=C1C.COC(=O)CCN.COC(=O)CN.COC(=O)CNC(=O)OCC1=CC=C(C2=CC=CC3=C2CCCN3C(=O)CCCOC2=CC=CC(C)=C2C)C=C1.Cl.O=C(OCC1=CC=C(Br)C=N1)OC1=CC=C([N+](=O)[O-])C=C1 ",
"input": "",
"output": " COC(=O)CCNC(=O)OCC1=CC=C(Br)C=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC1=NC2=C(O)C=C(C(=O)N(C)C)C=C2N1C.FC1=CC=C2C(=C1)OCCC2Cl as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CC1=NC2=C(OC3CCOC4=CC(F)=CC=C43)C=C(C(=O)N(C)C)C=C2N1C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(=O)O[BH-](OC(C)=O)OC(C)=O.CCN1CCNCC1.ClCCl.O=CC1=CC=C(Br)N=C1.[Na+].[OH-] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CCN1CCN(CC2=CC=C(Br)N=C2)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC1(C)C2=CC=CC(P(C3=CC=CC=C3)C3=CC=CC=C3)=C2OC2=C(P(C3=CC=CC=C3)C3=CC=CC=C3)C=CC=C21.C[C@H](C[C@H](O)[C@H](CC1=CC=CC=C1)NC(=O)C1=CC=C(F)C(Br)=C1)C(=O)NCCC(C)(C)C.O=C(/C=C/C1=CC=CC=C1)/C=C/C1=CC=CC=C1.O=C([O-])[O-].O=C1CCCN1.[Cs+].[Pd] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " C[C@H](C[C@H](O)[C@H](CC1=CC=CC=C1)NC(=O)C1=CC=C(F)C(N2CCCC2=O)=C1)C(=O)NCCC(C)(C)C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CCO.CCOC(=O)C(F)(F)C1=CC=C(Cl)C=C1.CN(C)C=O.O.O=C(Cl)C(=O)Cl.[K+].[OH-] ",
"input": "",
"output": " O=C(Cl)C(F)(F)C1=CC=C(Cl)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CCN(C(C)C)C(C)C.CCOCC.COC(=O)C(N)C(C)C.Cl.ClCCl.O=C(CBr)C1=CC=CC=C1 .",
"input": "",
"output": " COC(=O)C(NCC(=O)C1=CC=CC=C1)C(C)C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.CCCCOCCCC.CN(C)C1(C(N)C2=CC=CC=C2)CCCC1.CO.N#CC1(N(CC2=CC=CC=C2)CC2=CC=CC=C2)CCCC1.[BH4-].[Li]C1=CC=CC=C1.[Na+] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be NC(C1=CC=CC=C1)C1(N(CC2=CC=CC=C2)CC2=CC=CC=C2)CCCC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CO.COC(=O)CN=[N+]=[N-].O=CC1=CC=CC=C1Cl.[NaH] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be COC(=O)C(=CC1=CC=CC=C1Cl)N=[N+]=[N-] .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC#N.CC1=CC(C=O)=C(F)C=C1Br.Cl.O.OO.[Na+].[O-][Cl+][O-] , what product could potentially be produced?",
"input": "",
"output": "The product can be CC1=CC(C(=O)O)=C(F)C=C1Br .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(=O)OCC(=O)Cl.CC1=CC(C2=NC=NC3=C2NC(C)=C3C(=O)NC2CCNCC2)=C(OCC2CC2)C=C1F.Cl Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CC1=CC(C2=NC=NC3=C2NC(C)=C3C(=O)NC2CCN(C(=O)CO)CC2)=C(OCC2CC2)C=C1F .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C#C[Si](C)(C)C(C)(C)C.FC1=CC(Br)=CN=C1Br Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CC(C)(C)[Si](C)(C)C#CC1=NC=C(Br)C=C1F .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C1CCOC1.COC(=O)CN1CCN(C2=CC=C(C#N)C=C2)CC1.[Cl-].[Li+].[NH4+].[OH-] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " N#CC1=CC=C(N2CCN(CC(=O)O)CC2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CC(C)(C)OC(=O)N(CC(=O)O)C1=CC=CC=C1.CCN(CC)CC.CCN=C=NCCCN(C)C.Cl.ClCCl.NCCNC1=NSC2=CC=CC=C12.ON1N=NC2=CC=CC=C21 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CC(C)(C)OC(=O)N[C@H](C(=O)NCCNC1=NSC2=CC=CC=C12)C1=CC=CC=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CCO.COC(=O)CCCCCCCCCCCCCCCCCCCN1C(=O)C2=CC=CC=C2C1=O.Cl.NN.O is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " NCCCCCCCCCCCCCCCCCCCC(=O)O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C1CCOC1.C=CCBr.CC1(C)C=CC(=O)CC1.CCOC(C)=O.N.[LiH] , what product could potentially be produced?",
"input": "",
"output": "The product can be C=CCC1CC(C)(C)CCC1=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CCN(C(C)C)C(C)C.CN(C)C(ON1N=NC2=CC=CC=C21)=[N+](C)C.CN(C)C=O.F[B-](F)(F)F.NC1=CC=C(Cl)C=C1.O=C([O-])C1=CC=CC2=C1CCN(CC1=CC=NC=C1)C2.[Na+] as the reactants and reagents.",
"input": "",
"output": " O=C(NC1=CC=C(Cl)C=C1)C1=CC=CC2=C1CCN(CC1=CC=NC=C1)C2 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCOC(=O)CC(C)=O.CO Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CCOC(=O)C[C@@H](C)O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC1=CC=CC=C1.CN(C)C1=CC=CC=N1.CN(C)C=O.CO.O=C(O)C1=CC(Cl)=C(Cl)C(C2=CC=CC=C2)=N1.O=S(Cl)Cl as the reactants and reagents.",
"input": "",
"output": " O=C(Cl)C1=CC(Cl)=C(Cl)C(C2=CC=CC=C2)=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CCC(C)(C)OO.CCCC(C)(C)OCC ",
"input": "",
"output": " CCCC(C)(C)OOC(C)(C)CC ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC1=C(COC2=CC=CC(CCl)=C2)N=C(C2=CC=CC=C2)O1.CCOC(=O)CCC1=CC(O)=NN1C1=CC=CC=C1.CN(C)C=O.O.O=C([O-])[O-].[K+] ",
"input": "",
"output": " CCOC(=O)CCC1=CC(OCC2=CC=CC(OCC3=C(C)OC(C4=CC=CC=C4)=N3)=C2)=NN1C1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CC(C)(C)OC(=O)C1CN(CC2=CC=C(/C(N)=N/O)C=C2)C1.CCN(C(C)C)C(C)C.CN(C)C=O.ClCCCl.O=C(O)C1=CC(C2=CC=CC=C2)=C(C(F)(F)F)S1.ON1N=NC2=CC=CC=C21 as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CC(C)(C)OC(=O)C1CN(CC2=CC=C(/C(N)=N/OC(=O)C3=CC(C4=CC=CC=C4)=C(C(F)(F)F)S3)C=C2)C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1=CC=C([PH](C2=CC=CC=C2)(C2=CC=CC=C2)[Pd]([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)[PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.CC(C)(C)[C@@H](NC(=O)C1=CN(COCC[Si](C)(C)C)C2=NC=C(Br)N=C12)C(=O)N1CCC(C#N)CC1.CCCC[Sn](CCCC)(CCCC)C1=CN(CC2CC2)C=N1.CN(C)C=O.[Cu]I ",
"input": "",
"output": " CC(C)(C)[C@@H](NC(=O)C1=CN(COCC[Si](C)(C)C)C2=NC=C(C3=CN(CC4CC4)C=N3)N=C12)C(=O)N1CCC(C#N)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CCC=C1.CC(C)(C)C(=O)CCC(=O)C(C)(C)C.CO.C[O-].[Na+] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CC(C)(C)C1=CC=C(C(C)(C)C)C2=C1C=CC2 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.CC1=CC=CC=C1.ClC1=CC=C2C=CC=CC2=N1.N#CCC1=CC=C2C=CC=CC2=N1.[H-].[Na+] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " N#CC(C1=CC=C2C=CC=CC2=N1)C1=CC=C2C=CC=CC2=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CO.Cl.NC(=O)C1=NC=CN1C1CC2=CC(N3C=CN=C3)=CC=C2C1=O as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: O=C1NC2=C(CC3=CC(N4C=CN=C4)=CC=C32)N2C=CN=C12 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) ClC1=NC=CC2=CC=CN=C12.NC1=CC=C(F)C=N1 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: FC1=CC=C(NC2=NC=CC3=CC=CN=C23)N=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC(C)[O-].CC1=CC=CC=C1C.CCOC(C)=O.COC1=C(C(C)(C)CC(O)(C=O)C(F)(F)F)C=CC(C)=C1Cl.NC1=CC=CC2=C1C=CNC2=O.O.[Cl-].[Na+].[Ti+4] .",
"input": "",
"output": " COC1=C(C(C)(C)CC(O)(C=NC2=CC=CC3=C2C=CNC3=O)C(F)(F)F)C=CC(C)=C1Cl ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. COC1=CC=CC(C2=NC(N3CCOCC3)=NC(Cl)=C2CCCl)=C1.COC1=CC=CC(C2=NC(N3CCOCC3)=NC3=C2CCN3C2=CC=CC(S(N)(=O)=O)=C2)=C1.NC1=CC=CC(S(N)(=O)=O)=C1 ",
"input": "",
"output": " NS(=O)(=O)C1=CC=CC(N2CCC3=C(C4=CC=CC(O)=C4)N=C(N4CCOCC4)N=C32)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CCCO.COC(=O)CC1=CC2=C(C=C1C(=O)C1=CC=C(OC)C=C1)OCO2.NN.O ",
"input": "",
"output": " COC1=CC=C(C2=NNC(=O)CC3=CC4=C(C=C23)OCO4)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CC(=O)O.CCOC(=O)C1=C(C2=CC=C(F)C=C2)N=C(N)S1.Cl.ClC(Cl)Cl.O.O=N[O-].[Na+] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CCOC(=O)C1=C(C2=CC=C(F)C=C2)N=C(Cl)S1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC(=O)OC(C)=O.COC1=C(OC2=CC=CC=C2F)C=CC=C1C(C)C(=O)O.I.O=S([O-])O.[Na+] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC1C(=O)OC2=C(OC3=CC=CC=C3F)C=CC=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC(C)CCBr.CN(C)C=O.CS(=O)([O-])=S.O.[Na+] ",
"input": "",
"output": " CC(C)CCOS(C)(=O)=S ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC1=C(C(=O)NCC2=CC=CC=C2)SC(N2CCNC2=O)=N1.FC(F)(F)C1=CC=C(CBr)O1.N#CC1=CC=C(CCl)C=C1 as the reactants and reagents.",
"input": "",
"output": " CC1=C(C(=O)NCC2=CC=CC=C2)SC(N2CCN(CC3=CC=C(C(F)(F)F)O3)C2=O)=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC1=CC=C(S(=O)(=O)O)C=C1.CCO.CCOC(C)=O.CCOC(OCC)OCC.COC1=CC=C(COC2=CC=C(CNC3=CC=C(I)C=C3N)C=C2OC)C=N1.O Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be COC1=CC=C(COC2=CC=C(CN3C=NC4=CC(I)=CC=C43)C=C2OC)C=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " ClCCl.N[C@@]1(C2=CC(Br)=CS2)CCOC[C@H]1CO.O=C(N=C=S)C1=CC=CC=C1 Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " O=C(NC(=S)N[C@@]1(C2=CC(Br)=CS2)CCOC[C@H]1CO)C1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C1CCOC1.COC1=CC=C(Br)C(OC)=C1.COC1=CC=CC=C1C1=NC(C)(C)CO1.II.[Cl-].[MgH2].[NH4+] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: COC1=CC=C(C2=CC=CC=C2C2=NC(C)(C)CO2)C(OC)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CC(C)=O.CC(C)O.CCOC(=O)C(C)=CC1=CC=C(CC(O)C2=CC=CN=C2)C=C1.O=S(=O)(O)O.O=[Cr](=O)=O as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CCOC(=O)C(C)=CC1=CC=C(CC(=O)C2=CC=CN=C2)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " Br.CCN(CC)CC.ClCCl.NCC[N+]12CCC(CC1)[C@@H](OC(=O)C(O)(C1=CC=CC=C1)C1=CC=CC=C1)C2.O=C(Br)C1=CC=CC=C1.[Br-] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " O=C(NCC[N+]12CCC(CC1)[C@@H](OC(=O)C(O)(C1=CC=CC=C1)C1=CC=CC=C1)C2)C1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.CC=O.CN1N=C(Br)N=C1Br.[Li]CCCC Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CC(O)C1=NC(Br)=NN1C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses ClC1=NC2=CC=CC=C2S1.NC1CCCC2=C1NC1=CC=C(Br)C=C21 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: BrC1=CC=C2NC3=C(CCCC3NC3=NC4=CC=CC=C4S3)C2=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C1COCCO1.CC(C)(C)[O-].CN(C)C1=CC=CC=C1C1=CC=CC=C1P(C1CCCCC1)C1CCCCC1.CN1CCN(C2=NC=CN3C(C4=CC=CC(Br)=N4)=CN=C23)CC1.NCC1=CC=C(Cl)C=C1.O=C(/C=C/C1=CC=CC=C1)/C=C/C1=CC=CC=C1.[Na+].[Pd] , what product could potentially be produced?",
"input": "",
"output": "The product can be CN1CCN(C2=NC=CN3C(C4=CC=CC(NCC5=CC=C(Cl)C=C5)=N4)=CN=C23)CC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC(C)(C)OC(=O)NC1CCN(C(=O)C2=CC3=NC=NC(OC4=CC=C(NC(=S)NC(=O)CC5=CC=CC=C5)C=C4F)=C3S2)C1.Cl.O=C(CC1=CC=CC=C1)NC(=S)NC1=CC=C(OC2=CC=NC3=C2SC(C2=CC=C(N4CCNCC4)C=C2)=C3)C(F)=C1 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " NC1CCN(C(=O)C2=CC3=NC=NC(OC4=CC=C(NC(=S)NC(=O)CC5=CC=CC=C5)C=C4F)=C3S2)C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C#CC1(C)CCC2=C(C)C(O)=C(C)C(C)=C2O1.C1=CC=C(P(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.IC1=CC=CC=C1 as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CC1=C(C)C2=C(CCC(C)(C#CC3=CC=CC=C3)O2)C(C)=C1O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CCOC(C)=O.COC(=O)[C@@H]1N2C(=O)[C@@H](NC(=O)OCC3=CC=CC=C3)[C@H]2SC1(C)C.[H][H].[Pd] ",
"input": "",
"output": " COC(=O)[C@@H]1N2C(=O)[C@@H](N)[C@H]2SC1(C)C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CCC1=CC=CC(CC)=C1C1=NC(C)=C(CN(C)[C@H]2CCCC3=CC=CC=C32)C(N2CCC3(CC2)OCCO3)=N1.CCOC(C)=O.Cl.[Na+].[OH-] .",
"input": "",
"output": " CCC1=CC=CC(CC)=C1C1=NC(C)=C(CN(C)[C@H]2CCCC3=CC=CC=C32)C(N2CCC(=O)CC2)=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " COC1=C2C(=C(O)C3=C4OC5(OC6CC(O)C(O)(C(C)=O)C(C)O6)C6OC(C(OC)OC)(OC6C4=C(C)C=C13)C51CO1)C(=O)C(O)CC2OC1CC(C)(O)C(OC(C)=O)C(C)O1.COC1=C2C(=C(O)C3=C4OC5(O[C@H]6C[C@@H](O)[C@@](O)(C(C)=O)[C@H](C)O6)C6OC(C(OC)OC)(OC6C4=C(C)C=C13)C5(O)CO)C(=O)C(O)CC2O[C@H]1C[C@@](C)(O)[C@H](OC(C)=O)[C@H](C)O1 Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " COC1=C2C(=C(O)C3=C4OC5(OC6CC(O)C(O)(C(C)O)C(C)O6)C6OC(C(OC)OC)(OC6C4=C(C)C=C13)C51CO1)C(=O)C(O)CC2OC1COC(C)(OC(C)=O)C(C)(O)C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CCOC(=O)C(CC1=CC=CC=C1)C(=O)OCC.CN(C)C=O.O=[N+]([O-])C1=CC=C(CCl)C=C1 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CCOC(=O)C(CC1=CC=CC=C1)(CC1=CC=C([N+](=O)[O-])C=C1)C(=O)OCC .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)O.CNCC(=O)O.ClC(C1=CC=CC=C1)C1=CC=CC=C1.O.[K+].[OH-] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CN(CC(=O)O)C(C1=CC=CC=C1)C1=CC=CC=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC(=O)NCCS(=O)(=O)N1CCN(S(=O)(=O)C2=CC=C(C3=CC=C(F)C=C3)S2)[C@@H](C(=O)NOC(C)(C)C)C1.COC1=CC=CC=C1.O.O=C(O)C(F)(F)F , what product could potentially be produced?",
"input": "",
"output": "The product can be CC(=O)NCCS(=O)(=O)N1CCN(S(=O)(=O)C2=CC=C(C3=CC=C(F)C=C3)S2)[C@@H](C(=O)NO)C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCC1=CC2=CC(S(C)(=O)=O)=CC(C3=CN(C)C(=O)C4=CC=CC=C34)=C2O1.CO.[Pd] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CCC1CC2=CC(S(C)(=O)=O)=CC(C3=CN(C)C(=O)C4=CC=CC=C34)=C2O1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.CCOC(=O)C1=CC(C2=CC=C(OC)C=C2)=NN1.[Al+3].[H-].[Li+].[Na+].[OH-] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be COC1=CC=C(C2=NNC(CO)=C2)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC(=O)CC(C)(C)SC(C)=O.CO.CO[Na].O.[BH4-].[Na+] .",
"input": "",
"output": " CC(=O)OC(C)CC(C)(C)S ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1=CC=NC=C1.CC1(C)COP(=O)(Cl)OC1.ClC(Cl)Cl.OCC1CC=CCC1 ",
"input": "",
"output": " CC1(C)COP(=O)(OCC2C=CCCC2)OC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC1=CC(C2=NC(CCl)=CO2)=CC=C1Cl.CN(C)C=O.N#CC1=C(N)N=C(S)C(C#N)=C1C1=CC=C(OCCO)C=C1.O=C([O-])O.[Na+] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CC1=CC(C2=NC(CSC3=NC(N)=C(C#N)C(C4=CC=C(OCCO)C=C4)=C3C#N)=CO2)=CC=C1Cl ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CI.COC1=CC2=C(C(=O)C(C)C2C)C(Cl)=C1Cl.COCCOC.[H-].[Na+] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be COC1=CC2=C(C(=O)C(C)(C)C2C)C(Cl)=C1Cl .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.CCOC(C)=O.COC1=CC=C2N=CC(Cl)=C(C=C(CNCC3=CC=CC=C3)[C@H]3CC[C@H](NC(=O)OC(C)(C)C)CC3)C2=N1.O.[Na+].[OH-] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " COC1=CC=C2N=CC3=C(C=C([C@H]4CC[C@H](NC(=O)OC(C)(C)C)CC4)CN3CC3=CC=CC=C3)C2=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC(C)N1N=CC2=C(C(=O)O)C=C(C3=CC=C(C4=CNN=C4)C=C3)N=C21.CC1=CC(C)=C(CN)C(=O)N1.CN1CCOCC1.CS(C)=O.ClCCCl.ON1N=NC2=CC=CN=C21 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC1=CC(C)=C(CNC(=O)C2=CC(C3=CC=C(C4=CNN=C4)C=C3)=NC3=C2C=NN3C(C)C)C(=O)N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC(C)(C#N)N=NC(C)(C)C#N.CC1=CC=C(Cl)C(OC2=CC(C#N)=CC(C(F)(F)F)=C2)=C1F.ClC(Cl)(Cl)Cl.O=C1CCC(=O)N1Br , what product could potentially be produced?",
"input": "",
"output": "The product can be N#CC1=CC(OC2=C(Cl)C=CC(CBr)=C2F)=CC(C(F)(F)F)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C1=CC=NC=C1.C1COCCO1.COC(=O)[C@@H](O)CCN.Cl.O=S(Cl)Cl .",
"input": "",
"output": " COC(=O)[C@H](Cl)CCN ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCN(C2CCNCC2)C1.C[C@@H]1CN(CC2=CC3=NC(C4=CC(F)=CC5=C4C=CN5)=NC(N4CCOCC4)=C3S2)C[C@H](C)N1 Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be FC1=CC(C2=NC(N3CCOCC3)=C3SC(CN4CCC(N5CCCC5)CC4)=CC3=N2)=C2C=CNC2=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)(C)OC(=O)N1CCC(NC2=CC=CC=C2F)CC1.FC1=CC=CC(NC2CCNCC2)=C1 Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be FC1=CC=CC=C1NC1CCNCC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CCN(C(C)C)C(C)C.CN(C)C=O.COC1=CC=C(C2=C(C3=CC=CC=C3)OC3=NC=NC(Cl)=C23)C=C1.N[C@H]1CCC[C@H](O)C1 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: COC1=CC=C(C2=C(C3=CC=CC=C3)OC3=NC=NC(N[C@H]4CCC[C@H](O)C4)=C23)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CN(C)C1=CC=C(N)C(C(=O)O)=C1.NC=O.O Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CN(C)C1=CC=C2N=CNC(=O)C2=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC1=C(C2=C(C(C)(C)O[SiH2]C(C)(C)C)OC(=O)C3=CC(OCC4=CC=CC=C4)=CC=C23)C=CC2=C1CCCO2.CCO.CN Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CC1=C(C2=C(CO)N(C)C(=O)C3=CC(OCC4=CC=CC=C4)=CC=C23)C=CC2=C1CCCO2 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCC(C)=O.CCOC(=O)CBr.CCOC(C)=O.CC[N+](CC)(CC)CC1=CC=CC=C1.O=C([O-])[O-].O=C1C=CC(C(C2=CC=CC=C2)C2=CC=CC=C2)=CN1C/C=C/C1=CC=CC2=C1C=CN2.[Cl-].[K+] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CCOC(=O)CN1C=CC2=C(/C=C/CN3C=C(C(C4=CC=CC=C4)C4=CC=CC=C4)C=CC3=O)C=CC=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CS(=O)(=O)C1COC(=O)[C@@H]1O.O=S(=O)(O)O Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CS(=O)(=O)C(CO)[C@@H](O)C(=O)O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " COC1=CC=C(C2=CC=CC=C2)C=C1.O=C1NC2=CC=C(Cl)C=C2C1=O Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be COC1=CC=C(C2=CC=CC=C2)C=C1C1(O)C(=O)NC2=CC=C(Cl)C=C21 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. COC1=CC=C(C(=O)Cl)C=C1C(C)(C)C.O=CC1=CC=C(CO)C=C1 ",
"input": "",
"output": " COC1=CC=C(C(=O)OCC2=CC=C(C=O)C=C2)C=C1C(C)(C)C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses COC1=CC=CC=C1OC.Cl.ClCCl.O=C(Cl)C(=O)Cl.O=C(O)CCCCC1=CC=CC=C1.[Al+3].[Cl-] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: COC1=CC=C(C(=O)CCCCC2=CC=CC=C2)C=C1OC .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CCO.COC(=O)C1=CC=C(C(=O)NC2=CC=CC(S(=O)(=O)C(F)(F)F)=C2)C=C1.NN.O ",
"input": "",
"output": " NNC(=O)C1=CC=C(C(=O)NC2=CC=CC(S(=O)(=O)C(F)(F)F)=C2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CCCCCC.CNCCCCN1C(C(=O)OC)=C2CCN(CC3=CC=C(F)C(Cl)=C3)C(=O)C2=C(O)C1=O.CO.C[Si](C)(C)C=[N+]=[N-].ClCCl as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CNCCCCN1C(C(=O)OC)=C2CCN(CC3=CC=C(F)C(Cl)=C3)C(=O)C2=C(OC)C1=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC(C)(C)OC(=O)NC1(C2=CC=C(C(=O)C(Br)C3=CC=CC=C3)C=C2)CCC1.CCO.CCOC1=CC=C(N)N=C1 , what product could potentially be produced?",
"input": "",
"output": "The product can be CCOC1=CN2C(C3=CC=CC=C3)=C(C3=CC=C(C4(NC(=O)OC(C)(C)C)CCC4)C=C3)N=C2C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using O=C(O)C1=CC=C(S(=O)(=O)O)C=C1.O=S(=O)(O)Cl.[KH] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " O=C(O)C1=CC=C(S(=O)(=O)Cl)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC(C)(C)OC(=O)N1CCC(N2C(=O)NC3=C(SC(C4=CC=CC=C4)=C3)C2=O)CC1.CCC1=NC(CCl)=CO1.CN(C)C=O.O=C([O-])[O-].[K+] ",
"input": "",
"output": " CCC1=NC(CN2C(=O)N(C3CCN(C(=O)OC(C)(C)C)CC3)C(=O)C3=C2C=C(C2=CC=CC=C2)S3)=CO1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CCN=C=NCCCN(C)C.CN(C)C=O.CN1C=NC(C(=O)O)=C1.N=C(NO)C1=CC=C(OC(F)(F)F)C=C1.ON1N=NC2=CC=CC=C21 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CN1C=NC(C2=NC(C3=CC=C(OC(F)(F)F)C=C3)=NO2)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C1CCOC1.CC1=C(Cl)C(C(=O)O)=NN(C)C1=O.C[Si](C)(C)[N-][Si](C)(C)C.NC1=CC=C(I)C=C1F.[Li+] .",
"input": "",
"output": " CC1=C(NC2=CC=C(I)C=C2F)C(C(=O)O)=NN(C)C1=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using NC1=CC(C(F)(F)F)=CC(C(F)(F)F)=C1Br.O=C(O)C1=CC(Cl)=CC=C1O as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " O=C(NC1=CC(C(F)(F)F)=CC(C(F)(F)F)=C1Br)C1=CC(Cl)=CC=C1O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)(C)OC(=O)NC1(C2=CC=C(C3=NC4=NC=C(Br)N4C=C3C3=CC=CC=C3)C=C2)CCC1.CO.Cl Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " NC1(C2=CC=C(C3=NC4=NC=C(Br)N4C=C3C3=CC=CC=C3)C=C2)CCC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CCOC(C)=O.COC1=CC(F)=C(C(C)C)C=C1C1=CC2=C([N+](=O)[O-])C=CC=C2C=C1CN1C(=O)O[C@H](C2=CC(C(F)(F)F)=CC(C(F)(F)F)=C2)[C@@H]1C.[Pd] ",
"input": "",
"output": " COC1=CC(F)=C(C(C)C)C=C1C1=CC2=C(N)C=CC=C2C=C1CN1C(=O)O[C@H](C2=CC(C(F)(F)F)=CC(C(F)(F)F)=C2)[C@@H]1C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)C[Al+]CC(C)C.CC1=CC=CC=C1.CCCCCC1=CC=C([C@H]2CC[C@H](C#N)CC2)C=C1.ClCCl.O=C([O-])C(O)C(O)C(=O)[O-].[H-].[K+].[Na+] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CCCCCC1=CC=C([C@H]2CC[C@H](C=O)CC2)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC#N.CN(CCO[Si](C)(C)C(C)(C)C)C(=O)C1=CC=C(F)C(Cl)=C1F.CN1C=CC(NC(=O)C2=CC(O)=CC(O[C@H]3CCOC3)=C2)=N1.O.O=C([O-])[O-].[K+] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CN1CCOC2=C(C=CC(OC3=CC(O[C@H]4CCOC4)=CC(C(=O)NC4=NN(C)C=C4)=C3)=C2Cl)C1=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C#CCN1CCCC1=O.CN1CCCC(C=NO)C1 Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CN1CCCC(C2=NOC(CN3CCCC3=O)=C2)C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " COC(=O)C1=CC=C(C)C(C2=CN=C(C)N2)=C1.ClC(Cl)(Cl)Cl.O=C1CCC(=O)N1Cl Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be COC(=O)C1=CC=C(C)C(C2=C(Cl)NC(C)=N2)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CCCCCC.CCCCCCC#CC1=CSC(C=O)=C1.O=C(O)CC(=O)O as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CCCCCCC#CC1=CSC(/C=C/C(=O)O)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: B.C1=CC=NC=C1.C=O.CC(=O)O.CO.COC1=CC(Cl)=CC=C1C1=NC(C)=C(C(=O)NNCC2=CC=C3C(=C2)C=CN3C)S1.Cl.[Na+].[OH-] .",
"input": "",
"output": " COC1=CC(Cl)=CC=C1C1=NC(C)=C(C(=O)NN(C)CC2=CC=C3C(=C2)C=CN3C)S1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)=O.CN(C)C=O.CN(CC(=O)O)S(=O)(=O)C1=C(C(N)=O)NC2=CC=C(Cl)C=C12.ClCCl.O=C(Cl)C(=O)Cl.[NH4+].[OH-] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CN(C(=O)CN)S(=O)(=O)C1=C(C(N)=O)NC2=CC=C(Cl)C=C12 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. C1CCOC1.CCOC(=O)C1=C(Br)SC(N2CCC3=CC=CC(C(=O)NC4=NC5=CC=CC=C5S4)=C3C2)=N1.C[Si](C)(C)CCOCCl ",
"input": "",
"output": " CCOC(=O)C1=C(Br)SC(N2CCC3=CC=CC(C(=O)N(COCC[Si](C)(C)C)C4=NC5=CC=CC=C5S4)=C3C2)=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC(C)(CO)CCCN1CC2CN(C(=O)OC(C)(C)C)CCN2C1=O.ClCCl.O=C(O)C(F)(F)F is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC(C)(CO)CCCN1CC2CNCCN2C1=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCOC1=CC(C=O)=CC=C1O.OCCCCCCCCCCCBr Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CCOC1=CC(C=O)=CC=C1OCCCCCCCCCCCO .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. C1=CC=CC=C1.C=O.CC1=CC=C(S(=O)(=O)O)C=C1.O=C(NCCSC1=CC=C(OC(F)(F)F)C=C1)OCC1=CC=CC=C1 ",
"input": "",
"output": " O=C(OCC1=CC=CC=C1)N1CCSC2=CC=C(OC(F)(F)F)C=C2C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC(=O)C(Br)C1=CC=C(C#N)C=C1.CCCCO.CCN(CC)CC.NC1=NC=CS1 as the reactants and reagents.",
"input": "",
"output": " CC1=C(C2=CC=C(C#N)C=C2)N2C=CSC2=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with Cl.N[C@@H](CC1=CC=CC=C1)C(=O)N1CCC(O)CC1.O=C(O)C1=CC2=CC=CC=C2N1 as the reactants and reagents.",
"input": "",
"output": " O=C(N[C@@H](CC1=CC=CC=C1)C(=O)N1CCC(O)CC1)C1=CC2=CC=CC=C2N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC1=CC=CC=C1.CCOCC.NNC1=CC=CC=C1.O=C(O)C1=CC=CN=C1C(=O)C1=CC=CC=C1 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " O=C1C2=CC=CN=C2C(C2=CC=CC=C2)=NN1C1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1=CC=NC=C1.C=CCOCCOCCOCCOCCO.CC1=CC=CC=C1.CN(C)C1=CC=CC=N1.Cl.O=C1CCC(=O)O1 as the reactants and reagents.",
"input": "",
"output": " C=CCOCCOCCOCCOCCOC(=O)CCC(=O)O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(=O)OC(C)=O.CC(=O)[O-].CC1=NC=CC([N+](=O)[O-])=C1C.CCOCC.[K+] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CC(=O)OC1=CC=NC(C)=C1C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC(C)O.CC1=CC=C(S(=O)(=O)N2C=CC3=C(CN)C=CC=C32)C=C1.CCN(C(C)C)C(C)C.ClC1=NC=CC(NC2=CC(C3CC3)=NN2)=N1 .",
"input": "",
"output": " CC1=CC=C(S(=O)(=O)N2C=CC3=C(CNC4=NC=CC(NC5=NNC(C6CC6)=C5)=N4)C=CC=C32)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C1CCOC1.C=CCO.CCOC(=O)C1=CN(C)C2=C(SC=C2CBr)C1=O.CCOCC.CN(C)C=O.NCC1=CC=C(Cl)C=C1.[Li]CCCC as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: C=CCOCC1=CSC2=C1N(C)C=C(C(=O)NCC1=CC=C(Cl)C=C1)C2=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CCO.CCOC(=O)C=C(C1=CC=CC=C1)C1=CC=C([N+](=O)[O-])C=C1.O.[K+].[OH-] as the reactants and reagents.",
"input": "",
"output": " O=C(O)C=C(C1=CC=CC=C1)C1=CC=C([N+](=O)[O-])C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC1=CC(Cl)=NC(Cl)=N1.CNCC(=O)OCC1=CC=CC=C1.Cl .",
"input": "",
"output": " CC1=CC(N(C)CC(=O)OCC2=CC=CC=C2)=NC(Cl)=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CN(CCCCCCCN)CCN(CC1=CC=C(F)C=C1)C1=CC=CC=N1.NCCCOC1=CC=CC(CN2CCCCC2)=C1.O=C(N1C=CN=C1)N1C=CN=C1 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CN(CCCCCCCNC(=O)NCCCOC1=CC=CC(CN2CCCCC2)=C1)CCN(CC1=CC=C(F)C=C1)C1=CC=CC=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CC(=O)C(Cl)(Cl)Cl.ClC(Cl)Cl.N[C@@H]1CC2=CC=CC=C2[C@H]1NC1=NC(C2CC2)=C(C2=CC=C(Cl)C=C2Cl)N=C1C1CC1 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CC(=O)N[C@@H]1CC2=CC=CC=C2[C@H]1NC1=NC(C2CC2)=C(C2=CC=C(Cl)C=C2Cl)N=C1C1CC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: BrC1=CN=CN=C1.C1CCOC1.CC(C)(C)OC(=O)N1C2CCC1CC(=O)C2.CCOC(C)=O.[Cl-].[Li]CCCC.[NH4+] .",
"input": "",
"output": " CC(C)(C)OC(=O)N1C2CCC1CC(O)(C1=CN=CN=C1)C2 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. O=C1N(CCCF)N=NN1C1=CC(O)=C(Cl)C=C1F.O=[N+]([O-])O ",
"input": "",
"output": " O=C1N(CCCF)N=NN1C1=C(F)C=C(Cl)C(O)=C1[N+](=O)[O-] ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CCOC(=O)C(C)CC(N)C1=C(OC)C=CC=C1OC.O=CC1=CC=CC(C2=CN=CS2)=C1 as the reactants and reagents.",
"input": "",
"output": " COC1=CC=CC(OC)=C1C1CC(C)C(=O)N1CC1=CC=CC(C2=CN=CS2)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CS(=O)(=O)C1=CN=CC(Br)=C1.[NH4+].[OH-] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CS(=O)(=O)C1=CN=CC(N)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC1=C(CCl)N=C(C(C)(C)C)O1.CCO[C@@H](CC1=CC=C(O)C=C1OC)C(=O)OC.O=C([O-])[O-].[Cs+].[I-].[K+] , what product could potentially be produced?",
"input": "",
"output": "The product can be CCO[C@@H](CC1=CC=C(OCC2=C(C)OC(C(C)(C)C)=N2)C=C1OC)C(=O)OC .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1=CC=C([PH](C2=CC=CC=C2)(C2=CC=CC=C2)[Pd]([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)[PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.C1CCOC1.CC[Si](CC)(CC)OC(C)(C)C1=NC2=NC=C(C3=CC=NC(Cl)=N3)N2C=C1.ClCCl.O=C([O-])[O-].O=[N+]([O-])C1=CC=CC(B(O)O)=C1.[Na+] as the reactants and reagents.",
"input": "",
"output": " CC[Si](CC)(CC)OC(C)(C)C1=NC2=NC=C(C3=CC=NC(C4=CC=CC([N+](=O)[O-])=C4)=N3)N2C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CCOC(C)=O.COC(=O)C1=CC(C2=CC=CC(C=C(F)F)=N2)=CC=C1Cl.[H][H].[Pd] as the reactants and reagents.",
"input": "",
"output": " COC(=O)C1=CC(C2=CC=CC(CC(F)F)=N2)=CC=C1Cl ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C1=CC=C(P(C2=CC=CC=C2)[C-]2C=CC=C2)C=C1.C1COCCO1.CCS(=O)(=O)NC1=CC=C(OCC2CC2)C(B2OC(C)(C)C(C)(C)O2)=C1.CN1C=C(Br)C2=C(OC=C2)C1=O.Cl[Pd]Cl.O.O=P([O-])([O-])[O-].[Fe+2].[K+] .",
"input": "",
"output": " CCS(=O)(=O)NC1=CC=C(OCC2CC2)C(C2=CN(C)C(=O)C3=C2C=CO3)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC(C)(C)OC(=O)N1CC=C(B2OC(C)(C)C(C)(C)O2)CC1.ClC1=C(Br)C=NC2=C1C=C(I)N2.Cl[Pd](Cl)([PH](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1)[PH](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1.O=C([O-])[O-].[K+] ",
"input": "",
"output": " CC(C)(C)OC(=O)N1CC=C(C2=CC3=C(Cl)C(Br)=CN=C3N2)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. C1CCOC1.CCO.COC(=O)CC1=C(C(=O)OC)C=CC(C#N)=C1Cl.COC(=O)CC1=CC(C#N)=C(Cl)C=C1C(=O)OC.O.[BH4-].[Ca+2].[Cl-].[Na+] ",
"input": "",
"output": " N#CC1=CC(CCO)=C(CO)C=C1Cl ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C=CC1=CC=CC=C1Br.O=C1NC2=CC=C(Cl)C=C2C1=O as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " C=CC1=CC=CC=C1C1(O)C(=O)NC2=CC=C(Cl)C=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CCCI.CO.NC1=NC=C(C2=CNC(=O)C=C2)C(C2=CC=CO2)=N1.O=C([O-])[O-].[K+] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CCCN1C=C(C2=CN=C(N)N=C2C2=CC=CO2)C=CC1=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CCCC1=NC2=C(C)C=C(C(=O)NC(C)C(C)=O)C=C2N1CC1=CC=C(C2=CC=CC=C2C(=O)OC(C)(C)C)C=C1.O=P(Cl)(Cl)Cl as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CCCC1=NC2=C(C)C=C(C3=NC(C)=C(C)O3)C=C2N1CC1=CC=C(C2=CC=CC=C2C(=O)O)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CCCCCCCCCCCCCC(=O)NC1=CC=C(Cl)C(NC2=NN(C3=C(Cl)C=C(Cl)C=C3Cl)C(=O)C2)=C1.CN(C)C=O.O.O=C(O)C1=CC=CC(N2N=NN=C2S)=C1 ",
"input": "",
"output": " CCCCCCCCCCCCCC(=O)NC1=CC=C(Cl)C(NC2=NN(C3=C(Cl)C=C(Cl)C=C3Cl)C(=O)C2SC2=NN=NN2C2=CC=CC(C(=O)O)=C2)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC1=CC=CC=C1.CCCCCCCCOC1=CC=C(C(N)=O)C(O)=C1.CCCC[Sn](=O)CCCC as the reactants and reagents.",
"input": "",
"output": " CCCCCCCCOC1=CC=C(C#N)C(O)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC(C)(C)OC(=O)N1CCN(C(=O)CCl)CC1.CCO.CN(C)C=O.CN1CCC2=C(C1)NC1=CC=C(Cl)C=C21.Cl.O=C(O)[C@@H]1CCCN1.O=P([O-])([O-])[O-].[Cu]I.[K+] ",
"input": "",
"output": " CN1CCC2=C(C1)N(CC(=O)N1CCNCC1)C1=CC=C(Cl)C=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C#CC1=CC=CC=C1C.CCCC[Sn](CCCC)(CCCC)N(C)C.[N-]=[N+]=NCC1=CC=CC=C1 , what product could potentially be produced?",
"input": "",
"output": "The product can be CCCC[Sn](CCCC)(CCCC)C1=C(C2=CC=CC=C2C)N(CC2=CC=CC=C2)N=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C[C@H](NC(=O)C1=CC(Cl)=CN=C1Cl)C1=CC=C(C(=O)OC(C)(C)C)C=C1.OC1=CC(F)=CC=C1Cl as the reactants and reagents.",
"input": "",
"output": " C[C@H](NC(=O)C1=CC(Cl)=CN=C1OC1=CC(F)=CC=C1Cl)C1=CC=C(C(=O)OC(C)(C)C)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCO.CCOCC.CCOCOC1=CC2=C(C=C1CN1C(=O)C3=CC=CC=C3C1=O)OCCO2.NN Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CCOCOC1=CC2=C(C=C1CN)OCCO2 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC(=O)OC(C)=O.N.O=C1N=C(C2=CC=CC=C2)C2=C(SC=C2)N1CC1CC1.O=[N+]([O-])O , what product could potentially be produced?",
"input": "",
"output": "The product can be O=C1N=C(C2=CC=CC=C2)C2=C(SC([N+](=O)[O-])=C2)N1CC1CC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1CCOC1.CCCC[N+](CCCC)(CCCC)CCCC.CO[C@@]1(C2=CC=C(Cl)C(CC3=CC=C(OC(F)(F)F)C=C3)=C2)O[C@H](CO[Si](C)(C)C(C)(C)C)[C@@H](OCC2=CC=CC=C2)[C@H](OCC2=CC=CC=C2)[C@H]1OCC1=CC=CC=C1.[F-] ",
"input": "",
"output": " CO[C@@]1(C2=CC=C(Cl)C(CC3=CC=C(OC(F)(F)F)C=C3)=C2)O[C@H](CO)[C@@H](OCC2=CC=CC=C2)[C@H](OCC2=CC=CC=C2)[C@H]1OCC1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC(=O)OC(C)=O.CN(C)C1=CC=NC=C1.COC1=CC=C(CC(C(O)CCC(C#N)(C2=CC=C(OC)C(OC)=C2)C(C)C)[N+](=O)[O-])C=C1OC.ClCCl ",
"input": "",
"output": " COC1=CC=C(CC(C(CCC(C#N)(C2=CC=C(OC)C(OC)=C2)C(C)C)OC(C)=O)[N+](=O)[O-])C=C1OC ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)(O)C1CCN(CC2=CC=C([N+](=O)[O-])C(N[C@H]3CC[C@H](C(=O)O)CC3)=C2)CC1.CN(C)C=O.O=C(N1C=CN=C1)N1C=CN=C1.[NH4+].[OH-] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CC(C)(O)C1CCN(CC2=CC=C([N+](=O)[O-])C(N[C@H]3CC[C@H](C(N)=O)CC3)=C2)CC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C=CCO[C@@H]1C[C@H](NC[C@@H](O)[C@@H](N)CC2=CC(F)=CC(F)=C2)C2=CC(Br)=CC=C21.CN1CC2CNCC2C1.O=C1CCCC=CCO[C@@H]2C[C@H](NC[C@@H](O)[C@H](CC3=CC(F)=CC(F)=C3)N1)C1=CC(Br)=CC=C12 as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CN1CC2CN(C3=CC=C4C(=C3)[C@@H]3C[C@H]4OCC=CCCCC(=O)N[C@@H](CC4=CC(F)=CC(F)=C4)[C@H](O)CN3)CC2C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC#N.CC(C)C1=C(S(=O)(=O)Cl)N2C=C(Cl)C(C#N)=CC2=N1.CCN(CC)CC.Cl.FC1(F)CNC1.O=C([O-])O.[Na+] .",
"input": "",
"output": " CC(C)C1=C(S(=O)(=O)N2CC(F)(F)C2)N2C=C(Cl)C(C#N)=CC2=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C1=CC=C(P(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.CC(=O)[O-].CCN(CC)CC.CCO.ClCCl.O.O=CO.[Pd+2] , what product could potentially be produced?",
"input": "",
"output": "The product can be CCC(CC=C(C)C)=NO .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " BrCC1CC1.CS(C)=O.O=C([O-])[O-].O=C1C=C(Cl)NC(=O)N1.[K+].[Na+].[OH-] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be O=C1C=C(Cl)N(CC2CC2)C(=O)N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1CCOC1.C=CC(=O)O.CCN(CC)CC.Cl.SC1=CC=CC=C1 ",
"input": "",
"output": " O=C(O)CCSC1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C1CCOC1.COC(=O)[C@H]1CC[C@H](C(=O)O)CC1.FC1=CC=CC=C1[Zn+].O=S(Cl)Cl.[I-] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: COC(=O)C1CCC(C(=O)C2=CC=CC=C2F)CC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)C1C(=O)NCCN1C[C@H]1CNCCN1.CCN(CC)CC.ClCCl.O=S(=O)(Cl)C1=CC=CS1 Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CC(C)C1C(=O)NCCN1C[C@H]1CN(S(=O)(=O)C2=CC=CS2)CCN1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCO.Cl.ClC1=NC=NC2=C1CCC2.NC1=CC=C(C(=O)CC(O)CC2CCN(CC3=CC=CC=C3)CC2)C=C1.O=C([O-])C(F)(F)F.O=C([O-])O.[Na+] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be O=C(/C=C/CC1CCN(CC2=CC=CC=C2)CC1)C1=CC=C(NC2=NC=NC3=C2CCC3)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C=C(C)[C@@H]1CC[C@]2(N)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC=C(C6=CC=C(C(=O)OC)C=C6)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]12.C=C(C)[C@@H]1CC[C@]2(NC(=O)CCN(C)C)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC=C(C6=CC=C(C(=O)O)C=C6)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]12.CCN1CCN(CC(=O)O)CC1 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " C=C(C)[C@@H]1CC[C@]2(NC(=O)CN3CCN(CC)CC3)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC=C(C6=CC=C(C(=O)O)C=C6)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CCO.CCOC(=O)C1=C2N=CC=C(C3=CSC=C3)N2N=C1.Cl.O.[K+].[OH-] as the reactants and reagents.",
"input": "",
"output": " O=C(O)C1=C2N=CC=C(C3=CSC=C3)N2N=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC#N.NC1=CC=C(Br)C=C1.O=C(O)C1(C(=O)O)CC1 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " O=C(O)C1CCN(C2=CC=C(Br)C=C2)C1=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using COC(=O)C1=C(C)C=CO1.Cl.[Na+].[OH-] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CC1=C(C(=O)O)OC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.CCOC(C)=O.COC(=O)C1=CC=CC2=C1C1=C(O)C=CC=C1N2CC1=CC=CC2=CC=CC=C12.Cl.[NH4+].[OH-] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be NC(=O)C1=CC=CC2=C1C1=C(O)C=CC=C1N2CC1=CC=CC2=CC=CC=C12 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CO.COC(=O)CNC(=O)CC1=CC([C@@H]2O[C@H](COCC3=CC=CC=C3)[C@@H](OCC3=CC=CC=C3)[C@H](OCC3=CC=CC=C3)[C@H]2OCC2=CC=CC=C2)=CC=C1Cl.NN as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: O=C1CNC(CC2=CC([C@@H]3O[C@H](COCC4=CC=CC=C4)[C@@H](OCC4=CC=CC=C4)[C@H](OCC4=CC=CC=C4)[C@H]3OCC3=CC=CC=C3)=CC=C2Cl)=NN1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1=CC=C([PH](C2=CC=CC=C2)(C2=CC=CC=C2)[Pd]([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)[PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.COCCOC.O.O=C([O-])[O-].O=[N+]([O-])C1=C(Br)C=NN1C1CCCCO1.O=[N+]([O-])C1=NN(C2CCCCO2)C=C1Br.OB(O)C1=CC(F)=CC=C1O.[K+] ",
"input": "",
"output": " O=[N+]([O-])C1=NN(C2CCCCO2)C=C1C1=CC(F)=CC=C1O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CCN(CC)CC.CS(=O)(=O)Cl.ClCCl.OCCC1=CC=C2OCC3=CC=CC=C3CC2=C1 ",
"input": "",
"output": " CS(=O)(=O)OCCC1=CC=C2OCC3=CC=CC=C3CC2=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC(=O)OCC(=O)N1CCC2=C(C1)SC(NC(=O)C1=CC=CC=C1)=C2C#N.[Na+].[OH-] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: N#CC1=C(NC(=O)C2=CC=CC=C2)SC2=C1CCN(C(=O)CO)C2 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC(C)O.CCN(CC)CC.COC(=O)C1CCNCC1.ClC1=CC=C2N=C(Cl)N=C(NCC3=CC=C4OCOC4=C3)C2=C1 , what product could potentially be produced?",
"input": "",
"output": "The product can be CCOC(=O)C1CCN(C2=NC(NCC3=CC=C4OCOC4=C3)=C3C=C(Cl)C=CC3=N2)CC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C(=NC1CCCCC1)=NC1CCCCC1.C1=CC(N2CCCC2)=CC=N1.CCCCCCCCO.ClCCl.O=C(O)C1CCN(C(=O)OCC2=CC=CC=C2)CC1 Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CCCCCCCCOC(=O)C1CCN(C(=O)OCC2=CC=CC=C2)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CC(=O)O.NC(N)=O.NC1=CC=CC=C1C(=O)C1=CC=CC=C1 as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " O=C1N=C(C2=CC=CC=C2)C2=CC=CC=C2N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC(C)(C)CC1CNC(C2=CC=CC(Cl)=C2F)C1(C#N)C1=CC=C(Cl)C=C1F.CC(C)(C)OC(=O)N1CCC(CN)CC1.CCN(CC)CC.ClCCl.O=C(Cl)Cl .",
"input": "",
"output": " CC(C)(C)C[C@@H]1CN(C(=O)NCC2CCN(C(=O)OC(C)(C)C)CC2)[C@H](C2=CC=CC(Cl)=C2F)[C@@]1(C#N)C1=CC=C(Cl)C=C1F ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C1COCCO1.CC(C)(C)[Si](C)(C)OCCBr.CNC(=O)C1=C(C2=CC=C(F)C=C2)OC2=CC(NS(C)(=O)=O)=C(C3=CC(C(=O)NC4(C5=CC=CC=C5)CC4)=CC=C3C)C=C12.Cl as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CNC(=O)C1=C(C2=CC=C(F)C=C2)OC2=CC(N(CCO)S(C)(=O)=O)=C(C3=CC(C(=O)NC4(C5=CC=CC=C5)CC4)=CC=C3C)C=C12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC[C@@H]1C[C@]1(NC(=O)OC(C)(C)C)C(=O)NS(=O)(=O)C1CC1.ClCCl ",
"input": "",
"output": " CC[C@@H]1C[C@]1(N)C(=O)NS(=O)(=O)C1CC1.Cl ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses BrBr.COC1=CC=C(C2CCCCC2)C=C1NC(N)=S.ClC(Cl)Cl.ClCCl as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: COC1=CC=C(C2CCCCC2)C2=C1N=C(N)S2 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1COCCN1.CC(C)(C)OC(=O)N1CC2=CC(Cl)=C(I)C=C2C1 Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CC(C)(C)OC(=O)N1CC2=CC(Cl)=C(N3CCOCC3)C=C2C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C=C=C(CC(O)C1=CC=CC=C1C=O)C[Si](C)(C)C.CCOC(C)=O.CCOCC.C[Si](C)(C)OS(=O)(=O)C(F)(F)F.O is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " C=C1CC2OC(C1=C)C1C=CC=C=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1CCOC1.CCOC(=O)CC1=CC=C(NC(=O)OCC2=CC=CC=C2)C=C1.CC[Mg]Br.Cl ",
"input": "",
"output": " CCC(O)(CC)CC1=CC=C(NC(=O)OCC2=CC=CC=C2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.CC1=CC(Br)=CC(C)=C1O[Si](C)(C)C(C)(C)C.CCCCCC.O=C1NC2=CC=CC=C2C1=O.[Cl-].[Li]CCCC.[NH4+] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CC1=CC(C2(O)C(=O)NC3=CC=CC=C32)=CC(C)=C1O[Si](C)(C)C(C)(C)C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1CCN(C2CCNCC2)C1.ClC1=CC=C(C2=CC=NC=C2)N=N1 ",
"input": "",
"output": " C1=CC(C2=CC=C(N3CCC(N4CCCC4)CC3)N=N2)=CC=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC(C)C[AlH]CC(C)C.CC1=CC=CC=C1.CCOC(=O)C1=C(C2=CCC(C)CC2)SN=C1Cl as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CC1CC=C(C2=C(CO)C(Cl)=NS2)CC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C=COCC.CC(=O)[O-].OCCC1CCCCC1.[Hg+] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be C=COCCC1CCCCC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C.CCOC(C)=O.C[C@@H](N[C@H]1CC[C@@H](C2=CC=C([N+](=O)[O-])C=C2)C1)C1=CC=CC2=CC=CC=C12.[H][H].[Pd] ",
"input": "",
"output": " C[C@@H](N[C@H]1CC[C@@H](C2=CC=C(N)C=C2)C1)C1=CC=CC2=CC=CC=C12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C(=NC1CCCCC1)=NC1CCCCC1.CC(C)[C@H](NC(=O)OCC1=CC=CC=C1)C(=O)OCC(COC(=O)CCC(=O)O)OC(=O)[C@@H](NC(=O)OCC1=CC=CC=C1)C(C)C.CN(C)C1=CC=NC=C1.CN(C)C=O.NC1=NC2=C(N=CN2[C@H]2C[C@H](F)[C@@H](CO)O2)C(=O)N1.ON1N=NC2=CC=CC=C21 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC(C)[C@H](NC(=O)OCC1=CC=CC=C1)C(=O)OCC(COC(=O)CCC(=O)OC[C@H]1O[C@@H](N2C=NC3=C2N=C(N)NC3=O)C[C@@H]1F)OC(=O)[C@@H](NC(=O)OCC1=CC=CC=C1)C(C)C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CCN(CC)CCOCCC1CCCCN1.O=C1NC2=CC=CN=C2N(C(=O)CCl)C2=CC=CC=C12 , what product could potentially be produced?",
"input": "",
"output": "The product can be CCN(CC)CCOCCC1CCCCN1CC(=O)N1C2=CC=CC=C2C(=O)NC2=CC=CN=C21 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C1CCOC1.CC(C)(C)OC(=O)N1[C@@H](CC2=CC=NC(Cl)=C2)[C@@H](CO[Si](C)(C)C(C)(C)C)OC1(C)C.CI.CN(C)CCO.[CH2-]CCC.[Li+] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CC1=CC(C[C@H]2[C@@H](CO[Si](C)(C)C(C)(C)C)OC(C)(C)N2C(=O)OC(C)(C)C)=CC(Cl)=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses COCC(C)N1CCCN(C2=CC=C(N3CCC4=CC(O)=CC=C4C3=O)C=C2OC)CC1.CS(=O)(=O)C[C@H]1CCCO1 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: COCC(C)N1CCCN(C2=CC=C(N3CCC4=CC(OC[C@H]5CCCO5)=CC=C4C3=O)C=C2OC)CC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CC=C2C(=C1)OC1=CC=CC=C12.O=C(O)C(F)(F)F.O=[N+]([O-])O Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " O=[N+]([O-])C1=CC=C2C(=C1)OC1=CC=CC=C12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)C(=O)NC1=CC=CC(C2CCN(CC3=CC=CC4=C3C=CN4)CC2)=C1.ClC1=CC=CC=C1I Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CC(C)C(=O)NC1=CC=CC(C2CCN(CC3=CC=CC4=C3C=CN4C3=CC=CC=C3Cl)CC2)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.CC1=C(C2=CC=C(C(F)(F)F)C=C2)OC=N1.C[Si](C)(C)[N-][Si](C)(C)C.ClC(Cl)(Cl)C(Cl)(Cl)Cl.[Li+] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CC1=C(C2=CC=C(C(F)(F)F)C=C2)OC(Cl)=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CC(=O)O.COC1=CC=C(/C=C/CCC(=O)O)C(OC)=C1 as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " COC1=CC=C(CCCCC(=O)O)C(OC)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCN(CC)CC.CCO.COC1=CC=C(CN)C(OC)=C1.N#CC1=NC(Cl)=CC=C1[N+](=O)[O-] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be COC1=CC=C(CNC2=CC=C([N+](=O)[O-])C(C#N)=N2)C(OC)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)(C)[Si](C)(C)OC[C@H](OC1=CC=C(Cl)C=N1)[C@H]1CNC[C@@H]1C1=CC=C(F)C(F)=C1.CC1=CC(C(=O)O)=CN=N1 Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CC1=CC(C(=O)N2C[C@H]([C@H](CO[Si](C)(C)C(C)(C)C)OC3=CC=C(Cl)C=N3)[C@@H](C3=CC=C(F)C(F)=C3)C2)=CN=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. C1=COCCC1.CC1=CC=CC=C1.CCCCCC.CCOC(C)=O.O=C(O)C(F)(F)F.OC1=NC=NC2=CC=C(I)C=C12 ",
"input": "",
"output": " IC1=CC=C2N=CN=C(OC3CCCCO3)C2=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1=CC=C([PH](C2=CC=CC=C2)(C2=CC=CC=C2)[Pd]([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)[PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.CC1(C)OB(C2=CC=C(S(N)(=O)=O)C=C2)OC1(C)C.CN(C)C=O.COC1=CC=C(CN2N=C(OS(=O)(=O)C(F)(F)F)C3=C(OC)N=CC=C32)C=C1.O.O=C([O-])[O-].[K+] as the reactants and reagents.",
"input": "",
"output": " COC1=CC=C(CN2N=C(C3=CC=C(S(N)(=O)=O)C=C3)C3=C(OC)N=CC=C32)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CC(=O)O.CCOC(OCC)OCC.NC1=CC(F)=C(CC(=O)O)C=C1F.[N-]=[N+]=[N-].[Na+] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: O=C(O)CC1=CC(F)=C(N2C=NN=N2)C=C1F .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C.CC(O)C1CCCN1CC1=CC=C([N+](=O)[O-])C=C1.CO.NN.O Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CC(O)C1CCCN1CC1=CC=C(N)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC1=CC=CC=C1OCC(O)CN(CC1=CC=CC=C1)C(C)(C)COC1=CC=C(C(N)=O)C=N1.CO.[H][H].[Pd] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CC1=CC=CC=C1OCC(O)CNC(C)(C)COC1=CC=C(C(N)=O)C=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CCO.Cl.N.N#CSC1=C(Br)C=C([N+](=O)[O-])C=C1[N+](=O)[O-].O.[Fe] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: NC1=CC(Br)=C2SC(N)=NC2=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C#CCBr.CC1=NC2=CN=C3C=CC=CC3=C2N1CCCO.C[N+](C)(C)CC1=CC=CC=C1.ClCCl.[Cl-].[Na+].[OH-] ",
"input": "",
"output": " C#CCOCCCN1C(C)=NC2=CN=C3C=CC=CC3=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C1=CC=NC=C1.CC(=O)[O-].CC(C)OC1=CC=C(B(O)O)C=C1.CC1=NC(C2CC2)=C(CC2=CC=C(C3=CC=CC=C3C#N)C=C2)C(=O)N1.CCN(CC)CC.CCOC(C)=O.ClCCl.[Cu+2] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CC1=NC(C2CC2)=C(CC2=CC=C(C3=CC=CC=C3C#N)C=C2)C(=O)N1C1=CC=C(OC(C)C)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " COC1=CC=C2C(Cl)=CC(C3=CC=C(C)C=C3)=NC2=C1.NCCO Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be COC1=CC=C2C(NCCO)=CC(C3=CC=C(C)C=C3)=NC2=C1.Cl .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C1COCCO1.C[C@@H]1CN(C2=NC=C(Cl)C=C2Cl)CCN1.FC(F)(F)C1=CC(Br)=C2NC(Cl)=NC2=C1 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: C[C@@H]1CN(C2=NC=C(Cl)C=C2Cl)CCN1C1=NC2=C(Br)C=C(C(F)(F)F)C=C2N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with BrCC1CCOCC1.OC1=CC=CC(Br)=C1F as the reactants and reagents.",
"input": "",
"output": " FC1=C(Br)C=CC=C1OCC1CCOCC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C1CCOC1.COC(=O)C1=CC2=CC(NC(=O)[C@@H]3N[C@@H](CC(C)(C)C)[C@](C#N)(C4=CC=C(Cl)C=C4F)[C@H]3C3=CC=CC(Cl)=C3F)=CC=C2O1.Cl.O.[Li+].[OH-] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CC(C)(C)C[C@@H]1N[C@@H](C(=O)NC2=CC=C3OC(C(=O)O)=CC3=C2)[C@H](C2=CC=CC(Cl)=C2F)[C@@]1(C#N)C1=CC=C(Cl)C=C1F ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.CC(C)(C)C1=NN=C(C2=NN(C3=CC=C(Cl)C=C3Cl)C(C3=CC=C(Cl)C=C3)=C2CC#C[Si](C)(C)C)O1.CCCC[N+](CCCC)(CCCC)CCCC.CCOCC.O.[F-] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be C=C=CC1=C(C2=CC=C(Cl)C=C2)N(C2=CC=C(Cl)C=C2Cl)N=C1C1=NN=C(C(C)(C)C)O1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C#C[C@@](C)(O)C1=NOC(C)=C1.CN1C(=O)N(C2=CC=NC(N)=N2)C2=CC(Br)=CC=C21 ",
"input": "",
"output": " CC1=CC([C@](C)(O)C#CC2=CC=C3C(=C2)N(C2=CC=NC(N)=N2)C(=O)N3C)=NO1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC1=CC(C(F)(F)F)=CN=C1N1CCNCC1.CC1=CC(N2CCCS2(=O)=O)=CC=C1C(=O)O .",
"input": "",
"output": " CC1=CC(N2CCCS2(=O)=O)=CC=C1C(=O)N1CCN(C2=NC=C(C(F)(F)F)C=C2C)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C1=CCCCC1.CCCOC1=NC=NC(COCC2=CC=CC=C2)=C1C1=CC=C(OC)C=C1OCOC.CCO.O=C[O-].[NH4+].[OH-].[Pd+2] .",
"input": "",
"output": " CCCOC1=NC=NC(CO)=C1C1=CC=C(OC)C=C1OCOC ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(=O)NC1=NC(C=O)=CS1.O=C(O)C1=CC=C(C[P+](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C(F)=C1F.[Br-] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CC(=O)NC1=NC(C=CC2=CC=C(C(=O)O)C(F)=C2F)=CS1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C1CCOC1.CC(C)(C)OC(=O)N1CCC(C2=CC=C(C(=O)O)C=C2)CC1.CCN=C=NCCCN(C)C.CNOC.Cl.ON1N=NC2=CC=CC=C21 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CON(C)C(=O)C1=CC=C(C2CCN(C(=O)OC(C)(C)C)CC2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC#N.CC(C)(C)OC(=O)NC1CCNC1.CCN(CC)CC.IC1CCCC1 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CC(C)(C)OC(=O)NC1CCN(C2CCCC2)C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.CC1=CC(CO)=NN1C.CCCCC1=C(CC2=CC=C(C3=CC=CC=C3C#N)C=C2)C(=O)NC(C)=N1.CCCCP(CCCC)CCCC.CCOC(C)=O.O=C(N=NC(=O)N1CCCCC1)N1CCCCC1 Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CCCCC1=C(CC2=CC=C(C3=CC=CC=C3C#N)C=C2)C(=O)N(CC2=NN(C)C(C)=C2)C(C)=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCOC(C)=O.CN(C)C(=O)C1=CC=C(NC2=CC3=C(C=N2)C=C(C2=CN(C)N=C2)N3)C(Cl)=C1.CN(C)C=O.O.O=S(=O)(Cl)C1CCCC1 Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CN(C)C(=O)C1=CC=C(NC2=CC3=C(C=N2)C=C(C2=CN(C)N=C2)N3S(=O)(=O)C2CCCC2)C(Cl)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CCN(C(C)C)C(C)C.NCC1=CC=C(F)C(Cl)=C1.O=C1CSC(=S)N1 as the reactants and reagents.",
"input": "",
"output": " O=C1CSC(NCC2=CC=C(F)C(Cl)=C2)=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC(C)N1C(C(=O)O)=CC2=CC(C(=O)N3CCCN(C(=O)OC(C)(C)C)CC3)=CC=C21.CS(=O)(=O)N1CCNCC1.Cl ",
"input": "",
"output": " CC(C)N1C(C(=O)N2CCN(S(C)(=O)=O)CC2)=CC2=CC(C(=O)N3CCCN(C(=O)OC(C)(C)C)CC3)=CC=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C1CCOC1.CCN=C=NCCCN(C)C.Cl.ClCCl.NS(=O)(=O)C1=CC=CC=C1.O=C(O)C1=CC=CC(CC2=CC(Cl)=CC=C2OCC2=CC=C(Cl)C=C2F)=N1 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: O=C(NS(=O)(=O)C1=CC=CC=C1)C1=CC=CC(CC2=CC(Cl)=CC=C2OCC2=CC=C(Cl)C=C2F)=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C1CCOC1.CN.C[C@]12C[C@H](F)[C@@H]3C4=CC=C(O)C=C4C[C@@H](CCCCCCI)[C@H]3[C@@H]1CCC2=O is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CNC(C)CCCC[C@@H]1CC2=CC(O)=CC=C2[C@@H]2[C@@H]1[C@@H]1CCC(=O)[C@@]1(C)C[C@@H]2F ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(=O)NC1=CC=C(O)C=C1.CN(C)C=O.Cl.ClCC1=CC=C2C=CC=CC2=N1.O=C([O-])[O-].[K+] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CC(=O)NC1=CC=C(OCC2=CC=C3C=CC=CC3=N2)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1CCNC1.O=C(O)C1=CC=CC(COC2=CC=C3CCN(C4CCCC4)CCC3=C2)=C1 ",
"input": "",
"output": " O=C(C1=CC=CC(COC2=CC=C3CCN(C4CCCC4)CCC3=C2)=C1)N1CCCC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. C1CCOC1.CC1=CC=C(Cl)C=C1Br.CCCCCC.CON(C)C(=O)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1.[Li]CCCC ",
"input": "",
"output": " CC1=CC=C(Cl)C=C1C(=O)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCCCN(CC1=CC=C(Cl)C(Cl)=C1)C(=O)C1=NN(C2=CC=C(C(=O)NS(=O)(=O)C3=CC=C4C=CC=C(OCCN5CCOCC5)C4=C3)C=C2C(=O)O)C(C)=C1Cl.[N-]=[N+]=NC[C@@H]1CC2=CC=CC=C2CN1 Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CCCCN(CC1=CC=C(Cl)C(Cl)=C1)C(=O)C1=NN(C2=CC=C(C(=O)NS(=O)(=O)C3=CC=C4C=CC=C(OCCN5CCOCC5)C4=C3)C=C2C(=O)N2CC3=CC=CC=C3C[C@H]2CN=[N+]=[N-])C(C)=C1Cl .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1=CC=C([PH](C2=CC=CC=C2)(C2=CC=CC=C2)[Pd]([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)[PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.CCOC(=O)N1CC2C=C(OS(=O)(=O)C(F)(F)F)CC(C2)C1.COCCOC.O.O=C([O-])[O-].OB(O)C1=CN=CC(OC2=CC=CC=C2)=C1.[Cl-].[Li+].[Na+] ",
"input": "",
"output": " CCOC(=O)N1CC2C=C(C3=CN=CC(OC4=CC=CC=C4)=C3)CC(C2)C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C1=CC=CC=C1.CO.COC(=O)C(O)(C1=CC=CC=C1)C1=CC=CC=C1.C[O-].Cl.OC1CCCNC1.[Na+] , what product could potentially be produced?",
"input": "",
"output": "The product can be O=C(OC1CCCNC1)C(O)(C1=CC=CC=C1)C1=CC=CC=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC1=NC(C)=C(CBr)N=C1C.CCOC(=O)/C=C/C1=CC=C(O)C(OC)=C1.CN(C)C=O.O.O=C([O-])[O-].[K+] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CCOC(=O)/C=C/C1=CC=C(OCC2=NC(C)=C(C)N=C2C)C(OC)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCO.ClCC1=CC=CC=C1I.S=C1N[C@H](C2=CC=CC=C2)[C@H](C2=CC=CC=C2)N1 Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be Cl.IC1=CC=CC=C1CSC1=N[C@@H](C2=CC=CC=C2)[C@@H](C2=CC=CC=C2)N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CCCC/C(=C\\C1=C(C)C(OC)=C(OC)C(OC)=C1OC)C(=O)O.CCOCC is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CCCC/C(=C\\C1=C(C)C(=O)C(OC)=C(OC)C1=O)C(=O)O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC(=O)NC[C@H]1CN(C2=CC=C(N3CCC(=C(C#N)C#N)CC3)C=C2)C(=O)O1.CC(C)(C)[O-].CS(C)=O.C[S+](C)(C)=O.[I-].[K+] , what product could potentially be produced?",
"input": "",
"output": "The product can be CC(=O)NC[C@H]1CN(C2=CC=C(N3CCC4(CC3)CC4(C#N)C#N)C=C2)C(=O)O1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. ClCCl.O=C(OO)C1=CC=CC(Cl)=C1.OCC1=CC=C2CCC3=CC=CC=C3SC2=C1.[Ca+2].[OH-] ",
"input": "",
"output": " O=S1C2=CC=CC=C2CCC2=CC=C(CO)C=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CNC(=S)NCC(C)OC.NS(=O)(=O)C1=CC(C(=O)CBr)=C(Cl)C=C1Cl ",
"input": "",
"output": " Br.COC(C)CN=C1SCC(O)(C2=CC(S(N)(=O)=O)=C(Cl)C=C2Cl)N1C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(=O)O[BH-](OC(C)=O)OC(C)=O.CC(Cl)Cl.CNCCNC(=O)OC(C)(C)C.O=CC1=CN(C2CCCCO2)N=C1I.[Na+] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CN(CCNC(=O)OC(C)(C)C)CC1=CN(C2CCCCO2)N=C1I ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C1=CC=C([PH](C2=CC=CC=C2)(C2=CC=CC=C2)[Pd]([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)[PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.C1COCCO1.CC(C)(C)COC1=CC=C2OC3=CC=C(Br)C=C3[C@@]3(COC(N)=N3)C2=C1.CCCC[Sn](CCCC)(CCCC)C1=CN=CC=N1.CO , what product could potentially be produced?",
"input": "",
"output": "The product can be CC(C)(C)COC1=CC=C2OC3=CC=C(C4=CN=CC=N4)C=C3[C@@]3(COC(N)=N3)C2=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC(=O)CCN1C=CC=N1.CCO.O=C(O)C1=CC=C2C(=C1)N=C(C1=CC=C3N=C(C4=CC(Br)=CC=C4O)C=CC3=C1)N2C1CCCCC1.[K+].[OH-] ",
"input": "",
"output": " O=C(O)C1=CC=C2C(=C1)N=C(C1=CC=C3N=C(CCN4C=CC=N4)C=CC3=C1)N2C1CCCCC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC1=NC(C2=CC=C(Cl)C=C2)=C(Cl)N1C(F)F.O=[N+]([O-])O is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC1=NC(C2=CC=C(Cl)C([N+](=O)[O-])=C2)=C(Cl)N1C(F)F ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1CCOC1.CC(C)[N-]C(C)C.CC1=C(C#N)C(C2=CC=CC([N+](=O)[O-])=C2)NC(=O)N1.O=C(Cl)OC1=CC=C([N+](=O)[O-])C=C1.[Li+] ",
"input": "",
"output": " CC1=C(C#N)C(C2=CC=CC([N+](=O)[O-])=C2)N(C(=O)OC2=CC=C([N+](=O)[O-])C=C2)C(=O)N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1=CC=C([PH](C2=CC=CC=C2)(C2=CC=CC=C2)[Pd-4]([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)[PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.C1CCOC1.CC(C)(C)C(=O)OCN1N=C(I)C2=CC(Br)=CN=C21.ClC1=CC=CC(C[Zn+])=C1.[Cl-] ",
"input": "",
"output": " CC(C)(C)C(=O)OCN1N=C(CC2=CC=CC(Cl)=C2)C2=CC(Br)=CN=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(=O)C1=NC=NC(Cl)=C1C.CCO.[BH4-].[Na+] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CC1=C(Cl)N=CN=C1C(C)O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC(=O)O.COC(=O)C1=CC([N+](=O)[O-])=C(C#N)S1.[Fe] .",
"input": "",
"output": " COC(=O)C1=CC(N)=C(C#N)S1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC(=O)O.N#CC1=CC=C(C(=O)CBr)C=C1.NC1=NC(NCCNC2=CC=C(C3=NC=CN3)C(C3=CC=C(Cl)C=C3Cl)=N2)=CC=C1[N+](=O)[O-].O.O=[N+]([O-])C1=CC=C(Cl)N=C1.O=[N+]([O-])[O-].[Ce+4].[NH4+] .",
"input": "",
"output": " N#CC1=CC=C(C2=NC(NCCNC3=CC=C([N+](=O)[O-])C=N3)=CC=C2C2=NC=CN2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC(=O)O.CC(C)(C)O.CC=C(C)C.COC1=CC=C([C@H](CC2=CC=NC=C2)C2=CC=C(CC=O)C=C2)C=C1OC1CCCC1.O.O=P([O-])(O)O.[Na+].[O-][Cl+][O-] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: COC1=CC=C([C@H](CC2=CC=NC=C2)C2=CC=C(CC(=O)O)C=C2)C=C1OC1CCCC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using BrC(Br)(Br)Br.C1=CC=C(P(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.ClCCl.O=C([O-])O.[Na+] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " COC(=O)C1(CBr)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) Br.CN(C)C(=O)C1CCN(C2=CC=C(N)C=C2)CC1.O.O=N[O-].[Na+] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CN(C)C(=O)C1CCN(C2=CC=C(Br)C=C2)CC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C1=CC=C2CNCCC2=C1.Cl.N.O=S(=O)(O)O.O=[N+]([O-])[O-].[K+] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " O=[N+]([O-])C1=CC=C2CCNCC2=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC(C)(C)OC(=O)NCCN.CCO.N#C[S-].O=C(CBr)C1=CC=C(F)C=C1.[Na+] ",
"input": "",
"output": " CC(C)(C)OC(=O)NCCNC1=NC(C2=CC=C(F)C=C2)=CS1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC(S)S.CC1=CC=C(S(=O)(=O)O)C=C1.CCOCC.C[C@@]12CCC[C@H]1[C@@H]1CC[C@H]3CC(=O)CC[C@]3(CO)[C@H]1CC2.FB(F)F.[Ni] , what product could potentially be produced?",
"input": "",
"output": "The product can be C[C@@]12CCC[C@H]1[C@@H]1CC[C@H]3CCCC[C@]3(CO)[C@H]1CC2 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CCN1C=CC(Cl)=N1.O=S(=O)(O)Cl ",
"input": "",
"output": " CCN1C=C(S(=O)(=O)Cl)C(Cl)=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CCCN1N=C2C(Cl)=NC3=CC=CC=C3C2=C1N(CCC1CCN(C(=O)OC(C)(C)C)CC1)C(=O)OC(C)(C)C.CCO.CO.Cl.N is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CCCN1N=C2C(N)=NC3=CC=CC=C3C2=C1NCCC1CCNCC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C1CCOC1.CC(C)CCC1=C(OC2=CC=CC(C(F)(F)F)=C2)C=NC2=C1C(=O)N(CCCOC=O)C(=O)N2C.CCOC(C)=O.O.[Li]O is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC(C)CCC1=C(OC2=CC=CC(C(F)(F)F)=C2)C=NC2=C1C(=O)N(CCCO)C(=O)N2C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CCN(CC)CC.CN(C)C1=CC=NC=C1.CN=C=O.ClCCl.O.O=C1CC2=CC3=C(C=C2C(C2=CC=CC=C2)=NN1)OCO3 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CNC(=O)N1N=C(C2=CC=CC=C2)C2=CC3=C(C=C2CC1=O)OCO3 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC(=O)C(Cl)Cl.ClC(Cl)Cl.SCCCS ",
"input": "",
"output": " CC1(C(Cl)Cl)SCCCS1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CI.CN(C)C=O.COC(=O)C1=CC(I)=CC=C1NS(C)(=O)=O.O=C([O-])[O-].[K+] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be COC(=O)C1=CC(I)=CC=C1N(C)S(C)(=O)=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C=CCOC1(C)CCN(C2=C([C@H](OC(C)(C)C)C(=O)OC)C(C)=CC3=NC(C4=CC=CC(C5=C(O[C@@H](C)CC=C)C=CC(F)=C5F)=C4)=CN23)CC1.COC(=O)[C@@H](OC(C)(C)C)C1=C2N3CCC(C)(CC3)OCC=CC[C@H](C)OC3=CC(F)=CC=C3C3=CC(=CC=C3)C3=CN2C(=N3)C=C1C as the reactants and reagents.",
"input": "",
"output": " COC(=O)[C@@H](OC(C)(C)C)C1=C2N3CCC(C)(CC3)OCC=CC[C@H](C)OC3=CC=C(F)C(F)=C3C3=CC(=CC=C3)C3=CN2C(=N3)C=C1C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CN1CCCC1=O.COC1=CC=CC(OC)=C1C1=C2C=CC=CC2=C(C2=C(OC)C=CC=C2OC)C2=CC=CC=C12.Cl.[I-].[Li+] as the reactants and reagents.",
"input": "",
"output": " OC1=CC=CC(O)=C1C1=C2C=CC=CC2=C(C2=C(O)C=CC=C2O)C2=CC=CC=C12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. C1=CC=C(P(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.C=C[Sn](CCCC)(CCCC)CCCC.CN(C)C=O.COC(=O)[C@@H]1C[C@@H](OC(=O)N2CCC3=CC=CC(OS(=O)(=O)C(F)(F)F)=C3C2)CN1C(=O)OC(C)(C)C.Cl[Pd]Cl.[Cl-].[Li+] ",
"input": "",
"output": " C=CC1=CC=CC2=C1CN(C(=O)O[C@@H]1C[C@@H](C(=O)OC)N(C(=O)OC(C)(C)C)C1)CC2 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses BrC1=CN=C2NC=CC2=C1.CO.O.O=CC1=C(F)C=CC(OCCOC2CCCCO2)=C1F.[K+].[OH-] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: OC(C1=C(F)C=CC(OCCOC2CCCCO2)=C1F)C1=CNC2=NC=C(Br)C=C12 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using BrCCCCBr.N#CC1(C2=CC=CC=C2)CCCC1.N#CCC1=CC=C(Cl)C=C1 as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " N#CC1(C2=CC=C(Cl)C=C2)CCCC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC(=O)O.CC1=NC2=NC(CO)=NN2C(C)=C1.ClCCl.IC1=CC=CC=C1 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC1=NC2=NC(C=O)=NN2C(C)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.COC(=O)C1=C(CN)C=CS1.Cl Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be O=C1NCC2=C1SC=C2 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CN1CCCC1=O.COC(=O)C1=C(N)C2=C(S1)N(C1=CC=CC=C1C)C(=O)C1=CC=CC=C12.O.O=C([O-])O.O=P(Cl)(Cl)Cl.[Na+] as the reactants and reagents.",
"input": "",
"output": " COC(=O)C1=C(N=C2CCCN2C)C2=C(S1)N(C1=CC=CC=C1C)C(=O)C1=CC=CC=C12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C1=CC=NC=C1.CCOCC.COC(=O)C(C1=CC=C(F)C=C1)C(O)C1=CC=NC(SC)=N1.ClCCl.[Cr] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " COC(=O)C(C(=O)C1=CC=NC(SC)=N1)C1=CC=C(F)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC(=O)OO.CC(C)=CCCC(C)CCO.CC1=CC=CC=C1.O=C([O-])[O-].[Na+] ",
"input": "",
"output": " CC(CCO)CCC1OC1(C)C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.CCO.COC(=O)C1=CC=CC(C(=O)NC[C@H]2C[C@@H](C(=O)N3CCSC3)N(C(=O)OC(C)(C)C)C2)=C1.Cl.[Na+].[OH-] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " O=C(O)C1=CC=CC(C(=O)NC[C@@H]2CN[C@H](C(=O)N3CCSC3)C2)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCO.CSC(NC1=CC=CC(C(=O)O)=C1)=C(C#N)C(N)=O.NN.O Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be NC(=O)C1=C(N)NN=C1NC1=CC=C(C(=O)O)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C1COCCO1.CC(C)(C)OC(=O)N[C@H]1C[C@H](N2C(=O)N(C3CC3)C3=NC=CN=C32)C1.CO.Cl as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " N[C@H]1C[C@H](N2C(=O)N(C3CC3)C3=NC=CN=C32)C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CC1=CC(C(=O)O)=CN(C)C1=O.CCN(CC)CC.Cl.ClCCl.NC1=CC=C(F)C=C1NCC1=CC=CC=C1 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: C=C1C(C)=CC(C(=O)NC2=CC=C(F)C=C2NCC2=CC=CC=C2)=CN1C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. C#CC(C)(CCC(C)=C(C)C)OC(C)=O.CC(=O)[O-].[H][H].[Pb+2].[Pd] ",
"input": "",
"output": " CCC(C)(CCC(C)=C(C)C)OC(C)=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC1=CC=C(NC(=O)C2=CC=CC(N3CCOCC3)=C2)C=C1NC1=CC(Cl)=NC=N1.CCO.O=C[O-].[NH4+].[Pd] ",
"input": "",
"output": " CC1=CC=C(NC(=O)C2=CC=CC(N3CCOCC3)=C2)C=C1NC1=CC=NC=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. Cl.ClC(Cl)Cl.N#C[S-].NC1=CC=CC(Br)=C1.O=S([O-])O.[NH4+].[Na+] ",
"input": "",
"output": " NC(=S)NC1=CC=CC(Br)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CNC.Cl.O=C(O)C1=CC([N+](=O)[O-])=CC=C1Cl.[Na+].[OH-] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CN(C)C1=CC=C([N+](=O)[O-])C=C1C(=O)O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CCOC(OCC)[C@H](C)N(CC1=CC=CC2=CC=CN=C12)C(=O)[C@H](C)N.CN(CC(=O)O)NC(=O)NCC1=CC=C(Cl)C=C1 ",
"input": "",
"output": " CCOC(OCC)[C@H](C)N(CC1=CC=CC2=CC=CN=C12)C(=O)[C@H](C)NC(=O)CN(C)NC(=O)NCC1=CC=C(Cl)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC(=O)N1C2=CC=C(Br)C=C2N(C(=O)OC2CC(F)(F)C2)C[C@@H]1C.CC(=O)N1C2=CC=C(Br)C=C2NC[C@@H]1C.OC1CCOCC1 ",
"input": "",
"output": " CC(=O)N1C2=CC=C(Br)C=C2N(C(=O)OC2CCOCC2)C[C@@H]1C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CS(=O)(=O)OC1=CC=C(CO)C=C1.O=C(O)CC1=CC=C(CC(SCCC2=CC=C(F)C=C2)C(=O)OCC(Cl)(Cl)Cl)C=C1 ",
"input": "",
"output": " CS(=O)(=O)OC1=CC=C(COC(=O)CC2=CC=C(CC(SCCC3=CC=C(F)C=C3)C(=O)O)C=C2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC(C)(C)O.CC(C)(C)[O-].CCOC(C)=O.COC1=CC=C(C(C)=O)C(NC(=O)C2=NC(C(C)C)=CS2)=C1C.[Na+] as the reactants and reagents.",
"input": "",
"output": " COC1=CC=C2C(O)=CC(C3=NC(C(C)C)=CS3)=NC2=C1C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C=O.CN1C([N+](=O)[O-])=CN=C1C1=CNN(N)S1 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CN1C([N+](=O)[O-])=CN=C1C1=CNN(NCO)S1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC(C)(C)OC(=O)N1CCC(C2=NN=C([C@@H]3CC[C@@H]4CN3C(=O)N4OS(=O)(=O)[O-])S2)CC1.CCOCC.ClCCl.O=C(O)C(F)(F)F.[Na+] , what product could potentially be produced?",
"input": "",
"output": "The product can be O=C1N2C[C@@H](CC[C@H]2C2=NN=C(C3CCNCC3)S2)N1OS(=O)(=O)O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C1CCOC1.CC(C)(C)O[K].CCOCC.COC1=CN=C2C=CC=C(C=O)C2=N1.C[P+](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1.[Br-] .",
"input": "",
"output": " C=CC1=CC=CC2=NC=C(OC)N=C12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CN1C[C@H](CO)C=C2C3=CC=CC4=C3C(=CN4)C[C@H]21.CS(C)=O.C[Si](C)(C)I.N.O Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CN1C[C@H](CO)C=C2C3=CC=CC4=C3C(=C(I)N4)C[C@H]21 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CC(=O)O.O.O=C(CBr)CC(=O)OC(C1=CC=CC=C1)C1=CC=CC=C1.O=N[O-].[Cl-].[Na+] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " O=C(CBr)C(=NO)C(=O)OC(C1=CC=CC=C1)C1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1=CC=NC=C1.CCO.CON.Cl.ClCCl.N#CC1=CC=C(C(=O)NC2=CC=CC([C@]34CN(C5=NC=C(F)C=N5)C[C@H]3CSC(NC(=O)C3=CC=CC=C3)=N4)=C2)N=C1 as the reactants and reagents.",
"input": "",
"output": " N#CC1=CC=C(C(=O)NC2=CC=CC([C@]34CN(C5=NC=C(F)C=N5)C[C@H]3CSC(N)=N4)=C2)N=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C1CCOC1.CC(C)N(CC[C@H](C1=CC=CC=C1)C1=CC(Br)=CC=C1OCC1=CC=CC=C1)C(C)C.CCBr.II.O=C=O.[Cl-].[NH4+] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CC(C)N(CC[C@H](C1=CC=CC=C1)C1=CC(C(=O)O)=CC=C1OCC1=CC=CC=C1)C(C)C.Cl .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CC=C([PH](C2=CC=CC=C2)(C2=CC=CC=C2)[Pd]([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)([PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)[PH](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.COCCOC.O.OB(O)C1=CC=C(O)C=C1.OCCNC1=NN2C(Br)=CN=C2C=C1.[Cl-].[Na+].[OH-] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be OCCNC1=NN2C(C3=CC=C(O)C=C3)=CN=C2C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CN(C)C=O.N#CC1=CC=CN=C1Cl.OC1=CC=CN=C1.[H-].[Na+] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " N#CC1=CC=CN=C1OC1=CC=CN=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. C1CCNCC1.CC(=O)O.CCOC(=O)CC(C)=O.COC1=CC(C#N)=CC=C1C=O.ClCCl ",
"input": "",
"output": " CCOC(=O)C(=CC1=CC=C(C#N)C=C1OC)C(C)=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCN(CC)CC.CN(C)C(=O)[C@H]1CC[C@@H](O)[C@H](NS(=O)(=O)NC(=O)OC(C)(C)C)C1.CS(=O)(=O)Cl.ClCCl.O Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CN(C)C(=O)[C@H]1CC[C@@H]2NS(=O)(=O)N(C(=O)OC(C)(C)C)[C@@H]2C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CCOC(C)=O.CN(C)C=O.COC(=O)C1=CNC2=CC=CC=C12.FC(F)(F)C1=CC=C2N=CC=C(Cl)C2=C1.O.O=C([O-])[O-].[K+] ",
"input": "",
"output": " COC(=O)C1=CN(C2=CC=NC3=CC=C(C(F)(F)F)C=C23)C2=CC=CC=C12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1CCOC1.C=O.CC1=CC=CC=C1.CCN(CC)CC.CC[Mg]Br.COC1=CC=C(O)C(C23CC4CC(CC(C4)C2)C3)=C1 ",
"input": "",
"output": " COC1=CC(C=O)=C(O)C(C23CC4CC(CC(C4)C2)C3)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C=CCN.O=CC1=CC=NC=C1 as the reactants and reagents.",
"input": "",
"output": " C=CCN=CC1=CC=NC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C1=CC=C(P(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.CC(C)OC(=O)/N=N/C(=O)OC(C)C.O=C1NC=C(C2=CC=CC(Cl)=C2)C2=NC=CC=C12.OCC1=CC=CS1 as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " O=C1C2=CC=CN=C2C(C2=CC=CC(Cl)=C2)=CN1CC1=CC=CS1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: C1=CC=NC=C1.C1CCNCC1.Cl.O=C(O)CC(=O)O.O=CC1=CC=CC(Br)=N1 , what product could potentially be produced?",
"input": "",
"output": "The product can be O=C(O)C=CC1=CC=CC(Br)=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC1=CC=C(C2=CC=CC=C2O)C=C1.O=[N+]([O-])C1=CC=CC=C1F ",
"input": "",
"output": " CC1=CC=C(C2=CC=CC=C2OC2=CC=CC=C2[N+](=O)[O-])C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C#CCCC1=CC=CC=C1.CCN(CC)CC.Cl[Pd](Cl)([PH](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1)[PH](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1.N#CC1=NC=C(Br)C(NC2CCCC2)=N1.[Cl-].[Cu]I.[NH4+] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: N#CC1=NC=C(C#CCCC2=CC=CC=C2)C(NC2CCCC2)=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: Cl.NS(=O)(=O)C1=CC(C(=O)O)=CC([N+](=O)[O-])=C1Cl.O=C([O-])O.OC1=CC=CC(C(F)(F)F)=C1.[Na+] .",
"input": "",
"output": " NS(=O)(=O)C1=CC(C(=O)O)=CC([N+](=O)[O-])=C1OC1=CC=CC(C(F)(F)F)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CCO.O=C1N(C2=CC=C(F)C=C2)C=CC2=NC(COC3=CC=C(F)C=C3)=CN12.[H][H].[Ni] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " O=C1N(C2=CC=C(F)C=C2)CCC2=NC(COC3=CC=C(F)C=C3)=CN12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1=CC=C(P(C2=CC=CC=C2)C2=CC=C3C=CC=CC3=C2C2=C3C=CC=CC3=CC=C2P(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.CC(=O)[O-].CCN1N=CC(C)=C1N.CN(C)C=O.CONC(=O)C1=CC=CC=C1NC1=CC(Cl)=NC=C1Cl.O=C([O-])[O-].[Cs+].[Pd+2] ",
"input": "",
"output": " CCN1N=CC(C)=C1NC1=CC(NC2=CC=CC=C2C(=O)NOC)=C(Cl)C=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CC=NC=C1.CCCC(C)C.COC1=CC2=NC=NC(NC3=CC(N)=C(Cl)C=C3F)=C2C=C1OC.ClCCl.O=C(Cl)C1=CC=CC=C1 Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be COC1=CC2=NC=NC(NC3=CC(NC(=O)C4=CC=CC=C4)=C(Cl)C=C3F)=C2C=C1OC.Cl .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC(C)(C)OC(=O)OC1=CC(C2=CC=C(C3=CC=CC=C3)C=C2)=NN1C1=CC=CC=N1.CC(C)(C)OC(=O)OC1=CC(C2=CC=CC(C3=CC=C(OCC4=CC=CC=C4)C=C3)=C2)=NN1C1=CC=CC=N1 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: OC1=CC(C2=CC=CC(C3=CC=C(OCC4=CC=CC=C4)C=C3)=C2)=NN1C1=CC=CC=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) O=C([O-])C1=CC(Cl)=C(C(=O)[O-])C=C1Cl.O=[N+]([O-])[O-].[Ag+].[Na+] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: O=C(O)C1=CC(Cl)=C(C(=O)O)C=C1Cl .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC(=O)O.CCOC(=O)N1C2=C(C=C(C)N=C2C)C(=NO)CC1CC.[Zn] .",
"input": "",
"output": " CCOC(=O)N1C2=C(C=C(C)N=C2C)C(N)CC1CC ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CC(C)O.CCC1=CC=CC2=C1CCC2=O.[BH3-]C#N.[Na+] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CCC1=CC=CC2=C1CCC2N .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC(=O)OCC1=C(C(=O)O)N2C(=O)[C@@H](N)[C@H]2SC1.CO.C[N+](=O)[O-].Cl[Sb](Cl)(Cl)(Cl)Cl.O.O=C([O-])O.[Cl-].[Na+].[Zn+2] ",
"input": "",
"output": " COCC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C1CCOC1.CC1=CC=CC=C1.CCN(CC)CC.COC(=O)C1=C(N)C=CS1.O=C(Cl)Cl is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CNC(=O)NC1=C(C(=O)OC)SC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C1CCOC1.CC(C)C[Mg]Br.CCC1=C(C=O)C=C(C2=CC=C(C(F)(F)F)C=C2)O1 .",
"input": "",
"output": " CCC1=C(C(O)CC(C)C)C=C(C2=CC=C(C(F)(F)F)C=C2)O1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.C[C@@H]1COCCN1C1=NC(N2CCOC[C@H]2C)=C2N=C(C3=CC=CC=N3)N(C3CCCCO3)C2=N1.Cl.ClCCl.O=C([O-])[O-].[Na+] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be C[C@@H]1COCCN1C1=NC(N2CCOC[C@H]2C)=C2N=C(C3=CC=CC=N3)NC2=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CN(C)CC1=CC=CC(C#N)=C1.N.[Ni] ",
"input": "",
"output": " CN(C)CC1=CC=CC(CN)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CN(C)C=O.C[C@@H]1CN(CC2=CN=C3NC(=O)N4N=CN=C4C3=C2)C[C@H](C)O1.FC(F)(F)OC1=CC=C(CBr)C=C1.O=C([O-])[O-].[K+] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " C[C@@H]1CN(CC2=CN=C3C(=C2)C2=NC=NN2C(=O)N3CC2=CC=C(OC(F)(F)F)C=C2)C[C@H](C)O1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C1CCOC1.C=O.CC1=NC2=CC=CC(C3=CC4=C(CCNC4=O)N3)=C2N=C1NC(C)(C)C.CCO.CCOC(C)=O.O=C([O-])[O-].[K+] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CC1=NC2=CC=CC(C3=CC4=C(CCN(CO)C4=O)N3)=C2N=C1NC(C)(C)C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CS(=O)(=O)Cl.C[Si](C)(C)CCOCN1C=CC2=C(C3=CN(C4(CC#N)CN(C5CCNCC5)C4)C=C3)N=CN=C21.Cl is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CS(=O)(=O)N1CCC(N2CC(CC#N)(N3C=CC(C4=NC=NC5=C4C=CN5)=C3)C2)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC(C)(C)C1=NC(N2CCC(F)(F)C2)=C2N=NNC2=N1.CCN1N=NC2=C(N3CCC(F)(F)C3)N=C(C(C)(C)C)N=C21.CN1C(CI)=NN=C1S(C)(=O)=O ",
"input": "",
"output": " CN1C(CN2N=NC3=C(N4CCC(F)(F)C4)N=C(C(C)(C)C)N=C32)=NN=C1S(C)(=O)=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C=CCBr.CC(=O)N1CCC(C2=NC3=CC=CC=C3N2)CC1.CN(C)C=O.[H-].[Na+] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " C=CCN1C(C2CCN(C(C)=O)CC2)=NC2=CC=CC=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CC(=O)CN1CCC2=C(C1)C(=O)OC1=CC(C)=C(Cl)C=C21.CCN , what product could potentially be produced?",
"input": "",
"output": "The product can be CCNC(C)CN1CCC2=C(C1)C(=O)OC1=CC(C)=C(Cl)C=C21 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC(C)=O.O.O=S([O-])S(=O)[O-].O=[N+]([O-])C1=CC=C(C2=NC=NN2C2=CC=C(Br)C=C2)C=C1.[Na+] .",
"input": "",
"output": " NC1=CC=C(C2=NC=NN2C2=CC=C(Br)C=C2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC(=O)CO.CS(=O)(=O)Cl.ClC(Cl)Cl.O=C([O-])O.[Na+] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC(=O)COS(C)(=O)=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C1COCCO1.Cl.O=[N+]([O-])C1=CC=C(OC2=CC=NC3=CC(OCC4=CC=CC=C4)=CC=C23)C=C1 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: O=[N+]([O-])C1=CC=C(OC2=CC=NC3=CC(O)=CC=C23)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCOCC.CN(C)C=O.O.O=C=NC1=CC=C2OCOC2=C1.OCCCN1CCC(C2=NNC3=CC(F)=CC=C23)CC1 Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " O=C(NC1=CC=C2OCOC2=C1)OCCCN1CCC(C2=NNC3=CC(F)=CC=C23)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CC1=CC(O)=CC(OCC2=CC=CC=C2)=C1.CCN(C(C)C)C(C)C.ClCCl.O.O=S(=O)(Cl)C1=CC=CC2=CC=CC=C12 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CC1=CC(OCC2=CC=CC=C2)=CC(OS(=O)(=O)C2=CC=CC3=CC=CC=C23)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses CC#N.CC1=CC=CC=C1.CCOC(=O)C1CC=CCC1.[H-].[Na+] as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: N#CCC(=O)C1CC=CCC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(=O)O.CCC1CCC(C)CC1=O.Cl.NN(CC1=CC=C(Cl)C=C1)C1=CC=C(F)C=C1 Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CC1CC2=C(C(CC(=O)O)C1)N(CC1=CC=C(Cl)C=C1)C1=CC=C(F)C=C21 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC1=CC(C)=NC2=NC(=O)NS(=O)(=O)N12.CNOC.ClCCl ",
"input": "",
"output": " CON(C)S(=O)(=O)NC(=O)NC1=NC(C)=CC(C)=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using C1CCOC1.C=C1C[C@@H](C(=O)O)N(C(=O)OC(C)(C)C)C1.CCOCC.CN1CCOCC1.O.[BH4-].[Na+] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " C=C1C[C@@H](CO)N(C(=O)OC(C)(C)C)C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CCO.COC1=CC=CC=C1C1(O)C(O)CC(C2=CC=CC=C2)(C2=CC=CC=C2)C2CN(C(=O)CC3=CC=CC=C3OCC3=CC=CC=C3)CC21 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: COC1=CC=CC=C1C1(O)C(O)CC(C2=CC=CC=C2)(C2=CC=CC=C2)C2CN(C(=O)CC3=CC=CC=C3O)CC21 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " ClCCOCC1=CC=CC=C1.O=C1CCC(C2=CC=CC=C2)(C2=CC=CC=C2)C2CN(C(=O)CC3=CC=CC=C3O)CC12 Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be O=C1CCC(C2=CC=CC=C2)(C2=CC=CC=C2)C2CN(C(=O)CC3=CC=CC=C3OCCO)CC12 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC(C)=O.COC1=CC(OC)=C(/C=C/C(C2=CC=C(OC)C([N+](=O)[O-])=C2)S(=O)C(/C=C/C2=C(OC)C=C(OC)C=C2OC)C2=CC=C(OC)C([N+](=O)[O-])=C2)C(OC)=C1.O.O=S([O-])S(=O)[O-].[Na+] ",
"input": "",
"output": " COC1=CC(OC)=C(/C=C/C(C2=CC=C(OC)C(N)=C2)S(=O)C(/C=C/C2=C(OC)C=C(OC)C=C2OC)C2=CC=C(OC)C(N)=C2)C(OC)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC#N.CC(C)(C)OC(=O)N1CCNCC1.CCN(CC)CC.CCOC(C)=O.ClC1=NN(Cl)NC=C1.O.[Cl-].[Na+] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CC(C)(C)OC(=O)N1CCN(C2=NC=NC(Cl)=N2)CC1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " COCCl.ClCCl.Cl[Sn](Cl)(Cl)Cl.O=C1CC2=CC=CC=C2O1 Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be O=C1CC2=CC(CCl)=CC=C2O1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CCCN(CCC)C1=CC=C2NC(=S)CN=C(C3=CC=CC=C3[N+](=O)[O-])C2=C1.CCO.NNC=O as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CCCN(CCC)C1=CC=C2C(=C1)C(C1=CC=CC=C1[N+](=O)[O-])=NCC1=NN=CN21 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CCOCC.COC(=O)C1=C2CC3=CC=CC=C3CN2C(C2=CC=C(Cl)C=C2)=C1C(=O)OC.ClCCl.[Al+3].[H-].[Li+] as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " OCC1=C2CC3=CC=CC=C3CN2C(C2=CC=C(Cl)C=C2)=C1CO ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(=O)O.CCC1=NN(C2CCCC2)C(N)=C1C(N)=O.CCO.CCOC(=O)CN1C=NC2=CC=CC=C21.O.[NaH] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CCC1=C2C(=NC(CC3=NC4=CC=CC=C4N3)=NC2=O)N(C2CCCC2)N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C1CCOC1.CCN(CC)CC.CCOC(=O)Cl.NC1=CN2N=C(OC3=CC=CC(NC(=O)C4=CC=CC(C(F)(F)F)=C4)=C3)C=CC2=N1 .",
"input": "",
"output": " CCOC(=O)NC1=CN2N=C(OC3=CC=CC(NC(=O)C4=CC=CC(C(F)(F)F)=C4)=C3)C=CC2=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. COC1=CC=C(C(=O)Cl)C=C1.C[N+](C)=CC1=CC=CC=C1.OC1=CC=C2C=CC=CC2=C1.[Cl-] ",
"input": "",
"output": " COC1=CC=C(C(=O)OC2=CC=C3C=CC=CC3=C2C(C2=CC=CC=C2)N(C)C)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CO.Cl.O.O=C1NC(=O)C(CC2=CC=C(C(=O)/C=C/C3=CC=CC=C3)C=C2)S1.OO.[Na+].[OH-] as the reactants and reagents.",
"input": "",
"output": " O=C1NC(=O)C(CC2=CC=C(C(=O)C3OC3C3=CC=CC=C3)C=C2)S1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses BrBr.CC#N.CN(C)C=O.COC(=O)N1C=CC=CC1.NC(N)=O as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: COC(=O)N1CC=C[C@H]2OC(N)=N[C@H]21 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC[N+](CC)(CC)CC1=CC=CC=C1.ClCCl.[C-]#[N+]C(=C1CC[C@H]2[C@@H]3CC=C4C=C(OC)CC[C@]4(C)C3=CC[C@]12C)S(=O)(=O)C1=CC=C(C)C=C1.[Cl-].[Na+].[OH-] ",
"input": "",
"output": " [C-]#[N+]C(CCl)(C1=CC[C@H]2[C@@H]3CC=C4C=C(OC)CC[C@]4(C)C3=CC[C@]12C)S(=O)(=O)C1=CC=C(C)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CCOC(C)=O.CN(C)C=O.C[S-].O=C1C2=CC(CC3=CC=C(Cl)N=C3)=C3C=NC=CC3=C2N=CN1[C@H]1CCCC[C@@H]1O.[Na+] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CSC1=CC=C(CC2=CC3=C(N=CN([C@H]4CCCC[C@@H]4O)C3=O)C3=CC=NC=C23)C=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC#N.CC1(C)OB(C2=CC=C(C3=NC=CN3)C=C2)OC1(C)C.CCOC(C)=O.COC1=CC(C2=CN=C3C(=C2)C(I)=CN3S(=O)(=O)C2=CC=C(C)C=C2)=CC(OC)=C1OC.Cl[Pd](Cl)([PH](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1)[PH](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1.O=C([O-])[O-].[Na+] ",
"input": "",
"output": " COC1=CC(C2=CN=C3NC=C(C4=CC=C(C5=NC=CN5)C=C4)C3=C2)=CC(OC)=C1OC ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC(=O)Cl.CC(Cl)Cl.CCN(CC)CC.CN(C)C1=CC=CC=N1.NC1=NN=C2C3=C(CCCC3)C(N3CCOCC3)=NN12 as the reactants and reagents.",
"input": "",
"output": " CC(=O)NC1=NN=C2C3=C(CCCC3)C(N3CCOCC3)=NN12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C1CCOC1.CC1=CC(C(=O)O)=CC=C1N1CCOCC1=O.CCN(C(C)C)C(C)C.CN(C)C(ON1N=NC2=CC=CC=C21)=[N+](C)C.F[B-](F)(F)F.N[C@@H](CCC1=NN=NN1)C1=NC2=CC(Cl)=CC=C2N1 as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: CC1=CC(C(=O)N[C@@H](CCC2=NN=NN2)C2=NC3=CC(Cl)=CC=C3N2)=CC=C1N1CCOCC1=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C=CCCC(CC(OCC)OCC)OC.CC(=O)[O-].CCO.Cl.NO.O=CO.[Na+] ",
"input": "",
"output": " C=CCCC(CC=NO)OC ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1CCOC1.CC(C)[Mg]Cl.ClCCl.O=C1C(=O)N(C(C2=CC=CC=C2)C2=CC=CC=C2)C2=CC=CC=C12.OC1=CC(F)=C2OCCOC2=C1.[Cl-].[NH4+] as the reactants and reagents.",
"input": "",
"output": " O=C1N(C(C2=CC=CC=C2)C2=CC=CC=C2)C2=CC=CC=C2C1(O)C1=C(O)C=C2OCCOC2=C1F ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(=O)O.CC(C)(O)C1=CC=CC=C1O.CCOC(C)=O.CN(C)C=O.ClC1=CC=C2C=CC(/C=C/C3=CC=CC(C4CO4)=C3)=NC2=C1.O.O=C([O-])[O-].[K+] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CC(C)(O)C1=CC=CC=C1OCC(O)C1=CC=CC(/C=C/C2=CC=C3C=CC(Cl)=CC3=N2)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC(C)(C)OC(=O)NC1=CC=C(B2OC(C)(C)C(C)(C)O2)C=N1.O.O=C(/C=C/C1=CN(S(=O)(=O)C2=CC=C(Br)C=C2)C=C1)NOC1CCCCO1.O=C([O-])[O-].[Na+] as the reactants and reagents.",
"input": "",
"output": " CC(C)(C)OC(=O)NC1=CC=C(C2=CC=C(S(=O)(=O)N3C=CC(/C=C/C(=O)NOC4CCCCO4)=C3)C=C2)C=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C1CCOC1.COC1=CC(Cl)=C(N2C(=O)C3=CC=CC=C3C2=O)C=C1S.NN.O .",
"input": "",
"output": " COC1=CC(Cl)=C(N)C=C1S ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if NC1=CC=C(C2=NC(OC3CCOCC3)=NC(N3CCOCC3)=N2)C=C1.O=C=NC1=CC=CN=C1 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " O=C(NC1=CC=C(C2=NC(OC3CCOCC3)=NC(N3CCOCC3)=N2)C=C1)NC1=CC=CN=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CS(=O)(=O)N1CCN(CCOC2=CC=C3C(C4=CC(F)=CC(F)=C4)=C(Br)C(=O)C3=C2)CC1.O=C1C(Br)=C(C2=CC=CC=C2)C2=CC=C(OCCN3CCOCC3)C=C12.OB(O)C1=CN=C2C=CC=CC2=C1 as the reactants and reagents.",
"input": "",
"output": " CS(=O)(=O)N1CCN(CCOC2=CC=C3C(C4=CC(F)=CC(F)=C4)=C(C4=CN=C5C=CC=CC5=C4)C(=O)C3=C2)CC1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if CC1=CC=C(N)C=C1.CC1=CC=CC=C1NN=C(C#N)C#N.N#CCC#N.NN.O is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC1=CC=CC=C1NN=C1C(N)=NN=C1N ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC(C)O.CC1=CC=C(C(=O)O)C=C1N.CCN(CC)CC.ClC1=NC=CC=C1C1=CC=NC=N1.O=C(O)C(F)(F)F ",
"input": "",
"output": " CC1=CC=C(C(=O)O)C=C1NC1=NC=CC=C1C1=CC=NC=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. C1COCCO1.CC(=O)O.CC(C)(C)C(=O)Cl.CCN(CC)CC.CO.C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3[C@@H](O)C[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C.ClC(Cl)Cl.NCCS(=O)(=O)O.[Na+].[OH-] ",
"input": "",
"output": " C[C@H](CCC(=O)NCCS(=O)(=O)O)[C@H]1CC[C@H]2[C@@H]3CC[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC1=CC=C(CN)C=C1.CCOC(=O)C1=CN=C2C([N+](=O)[O-])=CC=CC2=C1Cl ",
"input": "",
"output": " CCOC(=O)C1=CN=C2C(N)=CC=CC2=C1NCC1=CC=C(C)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CC=C2NC=NC2=C1.CC#N.CC(=O)NC[C@H]1CN(C2=CC=C(N3C=NC(CO)=C3)C(F)=C2)C(=O)O1.CN(C)C(OCC(C)(C)C)OCC(C)(C)C Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " CC(=O)NC[C@H]1CN(C2=CC=C(N3C=NC(CN4C=NC5=CC=CC=C54)=C3)C(F)=C2)C(=O)O1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C1CCC2=NCCCN2CC1.CC#N.CCN1C=C(C(=O)O)C(=O)C2=CC(F)=C(Cl)N=C21.CN1CC2CCC(C1)N2.Cl as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CCN1C=C(C(=O)O)C(=O)C2=CC(F)=C(C3C4CCC(CN3C)N4)N=C21 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1=CC=C(P(C2=CC=CC=C2)C2=CC=CC=C2)C=C1.C1CCOC1.CC(C)(C)OC(=O)N=NC(=O)OC(C)(C)C.CO.COC1=CC(C2=CC=C3C(=O)NC4=CC(CCO)=CC=C4NC3=C2)=CC=C1[N+](=O)[O-].CS(C)=O.OC1=CC=C(Cl)N=C1 Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be COC1=CC(C2=CC=C3C(=O)NC4=CC(CCOC5=CC=C(Cl)N=C5)=CC=C4NC3=C2)=CC=C1[N+](=O)[O-] .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC1CCC(=O)N1[C@@H]1C2=CC([N+](=O)[O-])=CC=C2OCC[C@H]1O[Si](C)(C)C.O=[N+]([O-])C1=CC=C2OCCC3OC3C2=C1 ",
"input": "",
"output": " CC1CCC(=O)N1[C@@H]1C2=CC([N+](=O)[O-])=CC=C2OCC[C@H]1O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC1=CC(Cl)=CC=C1Cl.COC(CCCBr)(OC)OC .",
"input": "",
"output": " COC(=O)CCCCC1=CC(Cl)=CC=C1Cl ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Propose a potential product given these reactants and reagents. CC(=O)C(CC1=CC=C(S(C)(=O)=O)C=C1Cl)C(=O)SC(C)(C)C.NC1=CC(O)=CC=C1F ",
"input": "",
"output": " CC(=O)C(CC1=CC=C(S(C)(=O)=O)C=C1Cl)C(=O)NC1=CC(O)=CC=C1F ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CCN(CC)CCOC1=CC=C2C(=C1)C=C(C1=NN(C(=O)OC(C)(C)C)C3=CC=C(OCC4=CC=CC=C4)C=C13)N2C(=O)OC(C)(C)C.ClCCl.O=C(O)C(F)(F)F , what product could potentially be produced?",
"input": "",
"output": "The product can be CCN(CC)CCOC1=CC=C2NC(C3=NNC4=CC=C(OCC5=CC=CC=C5)C=C34)=CC2=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCOC1.CC(C)(C)OC(=O)N1CCC(=O)C1.FC1=CC=C(Br)C=C1Cl.II.[MgH2] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CC(C)(C)OC(=O)N1CCC(O)(C2=CC=C(F)C(Cl)=C2)C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. C1CCOC1.COC1=CC=C(C2=CC=NC(Cl)=C2)C=C1.C[Mg]Br ",
"input": "",
"output": " COC1=CC=C(C2=CC=NC(C)=C2)C=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC(=O)O.CC(C)N.ClCCl.O=CC1=COC([C@H](CCCC2CCCCC2)CC(=O)NOCC2=CC=CC=C2)=N1 ",
"input": "",
"output": " CC(C)NCC1=COC([C@H](CCCC2CCCCC2)CC(=O)NOCC2=CC=CC=C2)=N1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC(C)(C)C(=O)CC#N.CC(C)=O.CI.S=C=NC1=CC=C2OCOC2=C1 ",
"input": "",
"output": " CSC(NC1=CC=C2OCOC2=C1)=C(C#N)C(=O)C(C)(C)C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C1COCCO1.CCN(C(C)C)C(C)C.CSC1=NC(=O)N(CC2=CN=C(C(F)(F)F)S2)C(C)=N1.Cl.FC1=CC=C(C2=CCNCC2)C=C1 as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CC1=NC(N2CC=C(C3=CC=C(F)C=C3)CC2)=NC(=O)N1CC1=CN=C(C(F)(F)F)S1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Based on the given reactants and reagents: CON=C1C[C@@H](C(N)=NO)N(C(=O)C2=CC=C(C3=CC=CC=C3)C=C2)C1.C[C@@H](OC(C)(C)C)[C@H](NC(=O)OC(C)(C)C)C(=O)O , what product could potentially be produced?",
"input": "",
"output": "The product can be CON=C1C[C@@H](C2=NOC([C@@H](NC(=O)OC(C)(C)C)[C@@H](C)OC(C)(C)C)=N2)N(C(=O)C2=CC=C(C3=CC=CC=C3)C=C2)C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)(C)OC(=O)CBr.CC(C)=O.COC(=O)[C@H](CC1=CC=C(O)C=C1)NC1=CC=CC=C1C(=O)C1=CC=CC=C1.O=C([O-])[O-].[Cs+] Considering the given starting materials, what might be the resulting product in a chemical reaction?",
"input": "",
"output": " COC(=O)[C@H](C)NC1=CC=C(OCC(=O)OC(C)(C)C)C=C1C(=O)C1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CC(=O)O.CC(=O)O[BH-](OC(C)=O)OC(C)=O.ClCCCl.NC1=CC=C(F)C(F)=C1.O=CC1=CNC=N1.[Na+] ",
"input": "",
"output": " FC1=CC=C(NCC2=CNC=N2)C=C1F ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C1CCOC1.CC(C)=CCC/C(C)=C/CC/C(C)=C/CC/C(C)=C/CN.CCN=C=NCCCN(C)C.CCOP(=O)(CC(=O)O)OCC.Cl.ON1N=NC2=CC=CC=C21 is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CCOP(=O)(CC(=O)NC/C=C(\\C)CC/C=C(\\C)CC/C=C(\\C)CCC=C(C)C)OCC ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CO.CS(C)=O.Cl.N#CSC1=CC=C(O)C([N+](=O)[O-])=C1.O=C1C2=CC=CC=C2C(=O)N1CCBr.[Na+].[S-2] as the reactants and reagents.",
"input": "",
"output": " O=C1C2=CC=CC=C2C(=O)N1CCSC1=CC=C(O)C([N+](=O)[O-])=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(C)(C)OC(=O)N1C(=O)CCC1(C)C.CC(C)C[AlH]CC(C)C.CCOCC.CO Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be COC1CCC(C)(C)N1C(=O)OC(C)(C)C .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict a possible product from the listed reactants and reagents. CC(C)(C)OC(N)=O.N#CC1=CC=NC=C1N.NNC(=O)C1=CC=CC=C1F ",
"input": "",
"output": " O=C1NC2=CN=CC=C2C2=NC(C3=CC=CC=C3F)=NN12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. BrC1C2=CC=CC=C2C1Br.BrC1C2=CC=CC=C2C1I.CC1=CC=CC=C1C.O.O=C1C=CC(=O)C2=CC(C(F)(F)F)=CC=C12 ",
"input": "",
"output": " O=C1C2=CC=C(C(F)(F)F)C=C2C(=O)C2=CC3=CC=CC=C3C=C12 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) CC1=NC2=CC=C(NC(=O)C3=CC=C(C=NN)C=C3)C=C2CN(CCC2=CC=CC=C2)C1=O.O=C([O-])C(F)(F)F as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CC1NC2=CC=C(NC(=O)C3=CC=C(C=NN)C=C3)C=C2CN(CCC2=CC=CC=C2)C1=O .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with CC(=O)O[BH-](OC(C)=O)OC(C)=O.ClCCCl.O=C1NCN(C2=CC=CC=C2)C12CCNCC2.O=CC1=CC=CC=C1OC1=CC=CC=C1.[Na+] as the reactants and reagents.",
"input": "",
"output": " Cl.O=C1NCN(C2=CC=CC=C2)C12CCN(CC1=CC=CC=C1OC1=CC=CC=C1)CC2 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "A chemical reaction has started with the substance(s) C1CCOC1.CCOC(=O)C1=CN(C2=C(Cl)C=CC=C2Cl)C(C2=CC=C(Br)C=C2Cl)=N1.CCOCC.C[Mg+].[Br-] as the reactants and reagents, what could be a probable product?",
"input": "",
"output": "A probable product: CC(C)(O)C1=CN(C2=C(Cl)C=CC=C2Cl)C(C2=CC=C(Br)C=C2Cl)=N1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. COC1=CC=C(CNCCNC(=O)C2=C(NC3=CC=NC4=C3C=CN4)C=CS2)C=C1.O=CC1=CC=C2NC=CC2=C1 ",
"input": "",
"output": " O=C(NCCNCC1=CC=C2NC=CC2=C1)C1=C(NC2=CC=NC3=C2C=CN3)C=CS1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. C1=CC=[NH+]C=C1.CC(C)COC(=O)/C=C/CO.CCOCC.ClCCl.O=[Cr](=O)([O-])Cl ",
"input": "",
"output": " CC(C)COC(=O)/C=C/C=O ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CN(C)C=NC(=O)C1=CN(C2=CC=CC=C2)C(=O)C=C1OC1=CC=CC=C1.COC(OC)N(C)C.NC(=O)C1=CN(C2=CC=CC=C2)C(=O)C=C1OC1=CC=CC=C1 ",
"input": "",
"output": " O=C1C=C(OC2=CC=CC=C2)C(C2=NNC=N2)=CN1C1=CC=CC=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: C1CCOC1.C=C(C)CBr.CC(C)NC(C)C.CCC[C@@H](O)CC(=O)OC.CN(C)P(=O)(N(C)C)N(C)C.[Li]CCCC .",
"input": "",
"output": " C=C(C)C[C@@H](C(=O)OC)[C@H](O)CCC ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CCC1=NN2C(C)=CC(C)=NC2=C1CC1=CC=C(Br)C=C1.O=C(/C=C/C1=CC=CC=C1)/C=C/C1=CC=CC=C1.[K+].[OH-].[Pd] Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be CCC1=NN2C(C)=CC(C)=NC2=C1CC1=CC=C(O)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(=O)C1=CC=CC(O)=C1.ClCCCCCCBr Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CC(=O)C1=CC=CC(OCCCCCCCl)=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Given the following reactants and reagents, please provide a possible product. CN1CCCC1=O.FC1=NC=CC=C1C1CCCOC1.O.O=C([O-])[O-].OC1=CC=C(NC2=CC=CC=N2)C=C1.[Cs+] ",
"input": "",
"output": " C1=CC=C(NC2=CC=C(OC3=NC=CC=C3C3CCCOC3)C=C2)N=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Can you tell me the potential product of a chemical reaction that uses C1=CC=C2[Se]C=NC2=C1.C=O.CO.O as the reactants and reagents?",
"input": "",
"output": "Sure. A potential product: O=[Se]1CN(CO)C2=CC=CC=C21 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Using CCC(CC)(CC1NC(C(=O)OC(C)(C)C)C(C2=CC=CC(Cl)=C2F)C1(C#N)C1=CC=C(Cl)C=C1F)C(C)(C)O[SiH2]C(C)(C)C.ClCCl.O=C(O)C(F)(F)F as the reactants and reagents, tell me the potential product.",
"input": "",
"output": " CCC(CC)(CO)CC1NC(C(=O)O)C(C2=CC=CC(Cl)=C2F)C1(C#N)C1=CC=C(Cl)C=C1F ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " CC(=O)O.CC(Cl)Cl.CCC(C=O)NC1=CC(C)=NC(OC2=C(C)C=C(Cl)C=C2C)=C1C(=O)OC.CN.O=S(=O)([O-])[O-].[Na+].[NaH] Given the above reactants and reagents, what could be a probable product of their reaction?",
"input": "",
"output": "A probable product could be CCC(CNC)NC1=CC(C)=NC(OC2=C(C)C=C(Cl)C=C2C)=C1C(=O)OC .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Consider that for a chemical reaction, if C1CCOC1.CC(Br)C(=O)OC(C)(C)C.CC1=CC=CC2=C1C=C(C(=O)NCC1CCNCC1)C(=O)N2C(C)C.CCN(CC)CC.Cl.O=C([O-])O.[Na+] is/are the reactants and reagents, what can be the product?",
"input": "",
"output": " CC1=CC=CC2=C1C=C(C(=O)NCC1CCN(C(C)C(=O)OC(C)(C)C)CC1)C(=O)N2C(C)C ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Predict the product of a chemical reaction with C1CCOC1.C=CCN1C[C@@H](CO)[C@](N)(C2=CC=CC(Br)=C2)C1.O=C(N1C=CN=C1)N1C=CN=C1.O=C(N=C=S)C1=CC=CC=C1 as the reactants and reagents.",
"input": "",
"output": " C=CCN1C[C@H]2CSC(NC(=O)C3=CC=CC=C3)=N[C@@]2(C2=CC=CC(Br)=C2)C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": " C1CCNC1.CC1=CC=C(S(=O)(=O)O[C@@H]2CCN(CC3=CC=CC=C3)C2)C=C1.CCO Based on the reactants and reagents given above, suggest a possible product.",
"input": "",
"output": "A possible product can be C1=CC=C(CN2CC[C@H](N3CCCC3)C2)C=C1 .",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
},
{
"instruction": "Please provide a feasible product that could be formed using these reactants and reagents: CC1=CC([N+](=O)[O-])=C(C)C=C1Cl.CCN(C(C)C)C(C)C.CN1CCCC1=O.FC(F)(F)C1=CC=CC(CS)=C1 .",
"input": "",
"output": " CC1=CC([N+](=O)[O-])=C(C)C=C1SCC1=CC=CC(C(F)(F)F)=C1 ",
"metadata": {
"task": "forward_synthesis",
"split": "SMolInstruct"
}
}
]