task stringclasses 5
values | input stringlengths 89 339 |
|---|---|
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
Cc1ccc(C2(O)CC[NH+](Cc3cccnc3N)CC2)nc1
### Response:
1 |
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
Cc1ccc(C(=O)COC(=O)c2ccc(NS(C)(=O)=O)cc2)s1
### Response:
2 |
functional_group | ### Instruction:
Does the molecule contain a thiol group?
O=C(NCc1ccc(F)c(Cl)c1)N[C@H](CO)c1ccc(Cl)cc1
### Response:
No |
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
CC[C@@](C)([C@@H](N)c1ccccc1)[NH+]1CCCCC1
### Response:
4 |
functional_group | ### Instruction:
Does the molecule contain a amine group?
Cc1cscc1C[NH2+]CC[C@@H]1CSCCN1
### Response:
Yes |
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
C[C@H]1CCCN(C(=O)c2ccc(OCC(F)F)nc2)C1
### Response:
2 |
functional_group | ### Instruction:
Does the molecule contain a amide group?
COc1ccc(OC)c2sc(NC(=O)c3cc4cccc(OC)c4o3)nc12
### Response:
Yes |
fragment_assembly | ### Instruction:
Assemble these two molecular fragments into a single molecule.
Fragment 1: [4*][C@H](C)c1ccccc1
Fragment 2: [8*]CC(C)=O
### Response:
CC(=O)C[C@H]1CCCC[NH+]1[C@H](C)c1ccccc1 |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
C1(OC2=C([C@@H](c3c(cc(Cl)cc3)Cl)C=1C(=O)OCC)COC(C)=C2)N
### Response:
CCOC(=O)C1=C(N)OC2=C(COC(C)=C2)[C@H]1c1ccc(Cl)cc1Cl |
functional_group | ### Instruction:
Does the molecule contain a aldehyde group?
CC[C@H](C)[C@H](NC(=O)CSc1nc2ccccc2s1)C(N)=O
### Response:
No |
fragment_assembly | ### Instruction:
Assemble these two molecular fragments into a single molecule.
Fragment 1: [11*]Sc1nnc([14*])o1
Fragment 2: [5*]Nc1cccc(Cl)c1C
### Response:
Cc1c(Cl)cccc1NC(=O)CNC(=O)CSc1nnc(-c2ccc[nH]2)o1 |
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
N#C[C@@H]1CNCCN1CCOc1ccc(F)cc1
### Response:
2 |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
[C@@H]1(NC(=O)CSC2[NH+]=c3c(=[NH+]2)cccc3)Sc2c(N1)ccc([N+](=O)[O-])c2
### Response:
O=C(CSC1[NH+]=c2ccccc2=[NH+]1)N[C@H]1Nc2ccc([N+](=O)[O-])cc2S1 |
ring_counting | ### Instruction:
Count the six-membered rings in the following molecule.
Cc1nonc1C[C@@]1(C(=O)[O-])CCC[NH2+]C1
### Response:
1 |
fragment_assembly | ### Instruction:
Assemble these two molecular fragments into a single molecule.
Fragment 1: [15*]C1CC1
Fragment 2: [1*]C(=O)c1nc([14*])n2ccccc12
### Response:
CS[C@H](CO)[C@@H](C)NC(=O)c1nc(C2CC2)n2ccccc12 |
fragment_assembly | ### Instruction:
Assemble these two molecular fragments into a single molecule.
Fragment 1: [4*]Cc1cscn1
Fragment 2: [16*]c1ccc(Cl)c(F)c1
### Response:
O=C(NCc1cscn1)N[C@@H](CO)c1ccc(Cl)c(F)c1 |
ring_counting | ### Instruction:
Count the five-membered rings in the following molecule.
CCOC(=O)c1c(NC(=O)CCc2ccc(C)o2)sc2c1CCCC2
### Response:
2 |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
c1(C[NH+]2Cc3c(C2)ccc(OC)c3)ccccc1
### Response:
COc1ccc2c(c1)C[NH+](Cc1ccccc1)C2 |
functional_group | ### Instruction:
Does the molecule contain a amide group?
O=C(Cn1cnc2c([nH]c3ccccc32)c1=O)NCc1cccc(Cl)c1
### Response:
Yes |
ring_counting | ### Instruction:
Count the five-membered rings in the following molecule.
CCc1nn(C)cc1NC(=O)C(=O)N[C@H](C)c1ncc(-c2ccccc2)o1
### Response:
2 |
ring_counting | ### Instruction:
Count the six-membered rings in the following molecule.
CCN(C(=O)c1cc(C2CC2)n(C(C)(C)C)n1)c1ccc(F)c(F)c1
### Response:
1 |
ring_counting | ### Instruction:
Count the five-membered rings in the following molecule.
O=C([O-])[C@H]1CC(=O)N(Cc2ccccc2CN2CCCC2=O)C1
### Response:
2 |
ring_counting | ### Instruction:
Count the five-membered rings in the following molecule.
COc1ccc2[nH]cc([C@H](C(=O)[O-])[NH+]3CCN(Cc4cccc5ccccc45)CC3)c2c1
### Response:
1 |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
O=C(c1ccc(cc1)C(C)(C)C)NCC(N1CCC[C@@H](O)C1)=O
### Response:
CC(C)(C)c1ccc(C(=O)NCC(=O)N2CCC[C@@H](O)C2)cc1 |
functional_group | ### Instruction:
Does the molecule contain a aldehyde group?
CCc1ccc(S(=O)(=O)Nc2ccc3c(c2)CC(=O)N3)s1
### Response:
No |
fragment_assembly | ### Instruction:
Assemble these two molecular fragments into a single molecule.
Fragment 1: [5*]N([5*])CC(F)(F)F
Fragment 2: [5*]N([5*])Cc1ccc(C#N)cc1
### Response:
N#Cc1ccc(CN(CC(F)(F)F)C(=O)C[C@H]2OC(=O)c3ccccc32)cc1 |
functional_group | ### Instruction:
Does the molecule contain a nitrile group?
Cc1ccc(NC(=O)C(=O)N2CC[C@H]([NH+]3CCCC3)C2)cc1C(=O)N(C)C
### Response:
No |
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
COc1ccc(N2C(=O)N=C([O-])/C(=C\c3ccc[nH]3)C2=O)cc1
### Response:
1 |
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
CCOC(=O)c1cc(SC[C@@H](C)CO)ccc1N
### Response:
3 |
fragment_assembly | ### Instruction:
Assemble these two molecular fragments into a single molecule.
Fragment 1: [9*]n1cnnc1
Fragment 2: [5*]N([5*])C(C)C
### Response:
CC(C)N(CC[NH+]1CCCCCC1)C(=O)c1cccc(-n2cnnc2)n1 |
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
CCOc1cc2c(cc1NC(=O)CCc1c(C)[nH]c(=O)[nH]c1=O)O[C@@H](C)C2
### Response:
3 |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
n1cc(ccc1OC1CCC(NC(=O)Nc2ccc(cc2)COCC)CC1)C#N
### Response:
CCOCc1ccc(NC(=O)NC2CCC(Oc3ccc(C#N)cn3)CC2)cc1 |
ring_counting | ### Instruction:
Count the five-membered rings in the following molecule.
N#C[C@H](OC(=O)COC[C@@H]1CCCO1)C1CC1
### Response:
1 |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
C1CN(C(=O)c2c(n([C@@H](CC)C)nc2)C2CC2)C[C@@H]1COCC
### Response:
CCOC[C@@H]1CCN(C(=O)c2cnn([C@H](C)CC)c2C2CC2)C1 |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
c1cccc2ccc(N(C(c3cccc(-n4cnnn4)c3)=O)C)cc21
### Response:
CN(C(=O)c1cccc(-n2cnnn2)c1)c1ccc2ccccc2c1 |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
C(C(Nc1cc(ccc1F)C)=O)Sc1nnc(-c2ccc(cc2)Cl)o1
### Response:
Cc1ccc(F)c(NC(=O)CSc2nnc(-c3ccc(Cl)cc3)o2)c1 |
ring_counting | ### Instruction:
Count the five-membered rings in the following molecule.
C[C@@H]1[C@@H](C)C(=O)CC[NH+]1CCc1ccc(F)cc1
### Response:
0 |
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
COc1ccccc1Nc1nc(OCC(=O)[O-])cc(-c2ccc(C)cc2)n1
### Response:
2 |
ring_counting | ### Instruction:
Count the five-membered rings in the following molecule.
CC(C)CSCC(=O)NC1CCOCC1
### Response:
0 |
ring_counting | ### Instruction:
Count the six-membered rings in the following molecule.
C[C@]1(NC(=O)c2nn(-c3ccccc3)cc2[O-])CCS(=O)(=O)C1
### Response:
1 |
ring_counting | ### Instruction:
Count the six-membered rings in the following molecule.
Cc1ccc(Cl)c2c1NC(=O)/C2=N\NC(=O)c1ccc(Cl)cc1
### Response:
2 |
ring_counting | ### Instruction:
Count the six-membered rings in the following molecule.
CC(C)[C@@H]1C[NH2+]CC[C@@H]1[C@@H]1CCCOC1
### Response:
2 |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
N1(C2CC2)C(=O)c2cc(ccc2C1=O)C(Nc1ccc(cc1)OC)=O
### Response:
COc1ccc(NC(=O)c2ccc3c(c2)C(=O)N(C2CC2)C3=O)cc1 |
functional_group | ### Instruction:
Does the molecule contain a thiol group?
C[C@H](CNC(=O)Nc1cc(F)ccc1-n1cccn1)C[C@H](C)O
### Response:
No |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
c1c(C(=O)Nc2ccon2)scc1S(=O)(N1CCOCC1)=O
### Response:
O=C(Nc1ccon1)c1cc(S(=O)(=O)N2CCOCC2)cs1 |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
CC[C@@H]1CCCN(C1)S(=O)(c1c(F)ccc(C(=O)[O-])c1)=O
### Response:
CC[C@@H]1CCCN(S(=O)(=O)c2cc(C(=O)[O-])ccc2F)C1 |
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
CC(C)c1noc([C@H](C)Sc2nc3ccsc3c(=O)n2-c2ccccc2)n1
### Response:
3 |
functional_group | ### Instruction:
Does the molecule contain a amide group?
O=C(Nc1ccccc1NCC(F)(F)F)c1[nH]nc(C2CC2)c1Cl
### Response:
Yes |
fragment_assembly | ### Instruction:
Assemble these two molecular fragments into a single molecule.
Fragment 1: [4*][C@H](C)c1ccc(C)c(F)c1
Fragment 2: [5*]Nc1c(N)cccc1Cl
### Response:
Cc1ccc([C@@H](C)Nc2c(N)cccc2Cl)cc1F |
fragment_assembly | ### Instruction:
Assemble these two molecular fragments into a single molecule.
Fragment 1: [16*]c1cc(C)ccc1C
Fragment 2: [14*]c1csc(=O)[nH]1
### Response:
Cc1ccc(C)c(-c2csc(=O)[nH]2)c1 |
ring_counting | ### Instruction:
Count the five-membered rings in the following molecule.
CC[C@H](C(=O)NNC(=O)C[C@H](O)c1cccc(F)c1)c1ccccc1
### Response:
0 |
ring_counting | ### Instruction:
Count the six-membered rings in the following molecule.
COc1cc(/C=N/NC(C)=O)ccc1OC/C=C/c1ccccc1
### Response:
2 |
ring_counting | ### Instruction:
Count the six-membered rings in the following molecule.
COCCNC(=O)C(=O)NCc1ccccn1
### Response:
1 |
ring_counting | ### Instruction:
Count the five-membered rings in the following molecule.
O=C(NC[C@@H]1CC[NH+](C2CC2)C1)N1CCN(c2nccs2)CC1
### Response:
2 |
functional_group | ### Instruction:
Does the molecule contain a halide group?
[NH3+]Cc1ccccc1CS(=O)(=O)N1CCN2CCC[C@@H]2C1
### Response:
No |
ring_counting | ### Instruction:
Count the five-membered rings in the following molecule.
O=c1[nH]c(-c2cccnc2)nc2c1C[NH+](Cc1ccc(F)cc1)CC2
### Response:
0 |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
N(C)(C[C@H](C)c1ccccc1)Cn1nc(sc1=S)SC
### Response:
CSc1nn(CN(C)C[C@H](C)c2ccccc2)c(=S)s1 |
functional_group | ### Instruction:
Does the molecule contain a nitrile group?
O=C(COc1ccccc1-c1noc(-c2ccc(Cl)cc2)n1)N1CCCC1
### Response:
No |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
C1C[NH+](CCC1CN1C(c2ccccc2C1=O)=O)CC(Nc1cccc(c1)Cl)=O
### Response:
O=C(C[NH+]1CCC(CN2C(=O)c3ccccc3C2=O)CC1)Nc1cccc(Cl)c1 |
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
C[C@H]([NH2+]Cc1cn(CCC#N)nc1-c1ccccc1)[C@@H]1CN(C)CCO1
### Response:
3 |
ring_counting | ### Instruction:
Count the five-membered rings in the following molecule.
CCN(Cc1ccccc1Cl)C(=O)c1cc(S(N)(=O)=O)c(C)o1
### Response:
1 |
fragment_assembly | ### Instruction:
Assemble these two molecular fragments into a single molecule.
Fragment 1: [7*]Cc1ccc(F)cc1
Fragment 2: [8*]CCCC
### Response:
CCCCC1(C)OC(=O)C(=Cc2ccc(F)cc2)C(=O)O1 |
fragment_assembly | ### Instruction:
Assemble these two molecular fragments into a single molecule.
Fragment 1: [1*]C(=O)[C@@H]1CCO[C@@H]1C
Fragment 2: [16*]c1cccc(F)c1
### Response:
C[C@H]1OCC[C@H]1C(=O)Nc1cnccc1-c1cccc(F)c1 |
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
CN1CCO[C@H](Cn2ccc3c2CC(C)(C)CC3=O)C1
### Response:
1 |
fragment_assembly | ### Instruction:
Assemble these two molecular fragments into a single molecule.
Fragment 1: [1*]C(=O)N1CCN([5*])CC1
Fragment 2: [5*]N1CCN([5*])CC1
### Response:
CC(C)(C)OC(=O)N1CCN(C/C(N)=N\O)CC1 |
fragment_assembly | ### Instruction:
Assemble these two molecular fragments into a single molecule.
Fragment 1: [8*]CC(=O)N1N=C2CCCC[C@H]2[C@]1([13*])O
Fragment 2: [8*]C(F)(F)F
### Response:
O=C(Cc1ccc([N+](=O)[O-])cc1)N1N=C2CCCC[C@H]2[C@@]1(O)C(F)(F)F |
ring_counting | ### Instruction:
Count the five-membered rings in the following molecule.
CC1CCN(C(=O)Cn2cnc3c(cnn3C)c2=O)CC1
### Response:
1 |
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
CNC(=O)[C@@H]1CCC[NH+](Cc2cc(OC)c3c(c2)OCCO3)C1
### Response:
1 |
functional_group | ### Instruction:
Does the molecule contain a carboxyl group?
CC1CCC(NC(=O)c2ccc3c(c2)OCO3)CC1
### Response:
No |
ring_counting | ### Instruction:
Count the six-membered rings in the following molecule.
COc1c(C)cc(C)cc1-c1c(C#N)c(N)nc2c1C[C@H]([NH3+])CC2
### Response:
3 |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
CC(CC([NH2+][C@@H]1C[C@H](CCC1)[NH3+])(C)C)(C)C
### Response:
CC(C)(C)CC(C)(C)[NH2+][C@H]1CCC[C@H]([NH3+])C1 |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
N(C(NCc1ccc(OC)cc1)=O)[C@@H]1C(=O)N([C@H](C1)C)c1ccccc1
### Response:
COc1ccc(CNC(=O)N[C@H]2C[C@H](C)N(c3ccccc3)C2=O)cc1 |
ring_counting | ### Instruction:
Count the five-membered rings in the following molecule.
Cc1nc2ccc(NC(=O)[C@H](C)Oc3ccc4c(c3)OCO4)cc2c(=O)n1-c1ccccc1
### Response:
1 |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
C[C@@](NC(=O)c1cc(C#N)cs1)(CNC(OC(C)(C)C)=O)C1CC1
### Response:
CC(C)(C)OC(=O)NC[C@@](C)(NC(=O)c1cc(C#N)cs1)C1CC1 |
ring_counting | ### Instruction:
Count the six-membered rings in the following molecule.
CC[C@@H]1CCCC[NH+]1CCNC(=O)N[C@@H]1CCC[C@H]([S@@](=O)CC)C1
### Response:
2 |
fragment_assembly | ### Instruction:
Assemble these two molecular fragments into a single molecule.
Fragment 1: [12*]S(=O)(=O)c1ccc(F)cc1
Fragment 2: [3*]OCC
### Response:
CCOc1ccc([C@H]2CCCN2C(=O)C2CCN(S(=O)(=O)c3ccc(F)cc3)CC2)cc1 |
ring_counting | ### Instruction:
Count the six-membered rings in the following molecule.
CCSc1cc(C(=O)NCc2nc(-c3cccs3)n[nH]2)ccn1
### Response:
1 |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
c1cc(C(=O)n2c(nc(n2)-c2ccccc2)NCc2ccc(F)cc2)ccc1OC
### Response:
COc1ccc(C(=O)n2nc(-c3ccccc3)nc2NCc2ccc(F)cc2)cc1 |
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
CCc1nn(CC)c(CN2CCO[C@@H](C(N)=S)C2)c1Br
### Response:
2 |
ring_counting | ### Instruction:
Count the five-membered rings in the following molecule.
COc1cc2c(cc1OC)[C@H](C(=O)[O-])[C@H](c1cccc(Cl)c1)N(C)C2=O
### Response:
0 |
ring_counting | ### Instruction:
Count the six-membered rings in the following molecule.
Cc1nc(Nc2ncnc(N(CC#N)CC#N)c2N)sc1C
### Response:
1 |
ring_counting | ### Instruction:
Count the five-membered rings in the following molecule.
CCOc1cc(NC(=O)NC[C@@H](C)[NH+]2CCC[C@H](C)C2)ccc1OC
### Response:
0 |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
c1cnc2c(c(ccc2)NC(=O)c2c(ccs2)-c2ccccc2)c1
### Response:
O=C(Nc1cccc2ncccc12)c1sccc1-c1ccccc1 |
fragment_assembly | ### Instruction:
Assemble these two molecular fragments into a single molecule.
Fragment 1: [1*]C(=O)c1ccccc1[16*]
Fragment 2: [8*]C(F)(F)F
### Response:
Cc1cc(CCNC(=O)c2ccccc2C(F)(F)F)on1 |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
[NH2+](C1CCC(C(=O)OC(C)(C)C)CC1)Cc1ccc(C)cn1
### Response:
Cc1ccc(C[NH2+]C2CCC(C(=O)OC(C)(C)C)CC2)nc1 |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
c1c(O[C@H](C(C)C)C(=O)N2CCC(CC2)n2cccn2)cccc1Cl
### Response:
CC(C)[C@@H](Oc1cccc(Cl)c1)C(=O)N1CCC(n2cccn2)CC1 |
ring_counting | ### Instruction:
Count the five-membered rings in the following molecule.
Cc1ccc2oc(N/C(N)=N/C(=O)Nc3cccc(Cl)c3)nc2c1
### Response:
1 |
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
CC(C)C[C@H](NC(=O)c1csc2ncccc2c1=O)C(=O)N1CCc2ccccc21
### Response:
5 |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
C(c1oc(C[NH+]2CCC(CC2)C(=O)OCC)c(c(c1)=O)[O-])O
### Response:
CCOC(=O)C1CC[NH+](Cc2oc(CO)cc(=O)c2[O-])CC1 |
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
Cc1ccc(Br)cc1NC(=O)C(=O)NCCCO
### Response:
3 |
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
COc1ccc(S(=O)(=O)N(C)C(=O)C[C@H]2C=CCC2)cc1
### Response:
2 |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
[C@H]1([C@@H](CNC(c2ccco2)=O)O[C@H]([C@@H]1O)CC(N(Cc1ccccc1)C)=O)O
### Response:
CN(Cc1ccccc1)C(=O)C[C@@H]1O[C@H](CNC(=O)c2ccco2)[C@@H](O)[C@H]1O |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
CCn1ncc(c1)C(=O)N(C)CC1CCCC1
### Response:
CCn1cc(C(=O)N(C)CC2CCCC2)cn1 |
fragment_assembly | ### Instruction:
Assemble these two molecular fragments into a single molecule.
Fragment 1: [1*]C(=O)[C@@H]1CC(=O)N([10*])C1
Fragment 2: [16*]c1ccccc1[16*]
### Response:
CCOc1ccccc1N1C[C@H](C(=O)Nc2cccc(Cl)c2)CC1=O |
fragment_assembly | ### Instruction:
Assemble these two molecular fragments into a single molecule.
Fragment 1: [1*]C(=O)c1cccc([16*])c1
Fragment 2: [9*]n1cccc1
### Response:
CC(C)N(C)C(=O)C1CCN(C(=O)c2cccc(-n3cccc3)c2)CC1 |
ring_counting | ### Instruction:
Count the six-membered rings in the following molecule.
CN(Cc1ccc(F)cc1F)C(=O)CNC(=O)c1cc2ccccc2[nH]1
### Response:
2 |
functional_group | ### Instruction:
Does the molecule contain a aromatic_ring group?
CCc1nc2cc(NC(=O)C(=O)NC[C@@H]3CCC[C@H](O)C3)ccc2o1
### Response:
Yes |
ring_counting | ### Instruction:
Count the six-membered rings in the following molecule.
COC(=O)[C@H](NC(=O)COc1cc(Cl)c(Cl)cc1Cl)C(C)C
### Response:
1 |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
c1(=O)c(NC(C(N[C@H]2C[C@@H]2C2CCCCC2)=O)=O)cccn1C
### Response:
Cn1cccc(NC(=O)C(=O)N[C@H]2C[C@@H]2C2CCCCC2)c1=O |
fragment_assembly | ### Instruction:
Assemble these two molecular fragments into a single molecule.
Fragment 1: [5*]N1CCN(C2=[NH+]CC(C)(C)S2)CC1
Fragment 2: [1*]C(=O)CC[8*]
### Response:
CC(=O)N1CCC(CCC(=O)N2CCN(C3=[NH+]CC(C)(C)S3)CC2)CC1 |
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