smiles stringlengths 15 6.12k | source_id int64 1 5 |
|---|---|
FC(C=1C=C(C=CC1)N=C=O)(F)F.CC1=C(C=C(N)C=C1)C1=CC=C2C3=C(NC2=C1)N=CN=C3>>CC1=C(C=C(C=C1)NC(=O)NC1=CC(=CC=C1)C(F)(F)F)C1=CC=C2C3=C(NC2=C1)N=CN=C3 | 5 |
CN(C/C=C/C(=O)O)C.CC1=C(C=CC=C1C)N1CC=2N=C(N=C(C2CC1)N1C[C@@H](NCC1)CC#N)OC[C@H]1N(CCC1)C>ClCCl.C(C)(C)N(C(C)C)CC.F[P-](F)(F)(F)(F)F.N1(N=NC2=C1N=CC=C2)OC(=[N+](C)C)N(C)C>CN(C/C=C/C(=O)N1[C@H](CN(CC1)C=1C2=C(N=C(N1)OC[C@H]1N(CCC1)C)CN(CC2)C2=C(C(=CC=C2)C)C)CC#N)C | 3 |
NCCC1CCN(CC1)C(=O)OCC1=CC(=CC(=C1)Cl)Cl.C(=O)(O)C1=NN=N[N-]1.[K+]>CC#N.N(C)(C)C=O.c1ccncc1.C(C(=O)Cl)(=O)Cl>N=1NN=NC1C(=O)NCCC1CCN(CC1)C(=O)OCC1=CC(=CC(=C1)Cl)Cl | 3 |
NC=1N(C([C@]2([C@@]3([C@@H](OC=4C=CC(=CC24)O)CCCO3)C)N1)=O)C>>OC1=CC=2[C@@]3([C@@]4([C@@H](OC2C=C1)CCCO4)C)N=C(N(C3=O)C)/N=C/N(C)C | 5 |
[I-].C[P+](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1.CC1=CC=C2C(CCN(C2=N1)C(=O)OC(C)(C)C)=O>C1CCCO1.C(CCC)[Li].C(C)(=O)OCC.CCCCCC>CC1=CC=C2C(CCN(C2=N1)C(=O)OC(C)(C)C)=C | 3 |
CN1C2=CC=C(C=C2C=2CC(CCC12)C1CCOCC1)C(=O)O.[Cl-].C(C)[NH2+]CC(=O)NC>>C(C)N(C(=O)C=1C=C2C=3CC(CCC3N(C2=CC1)C)C1CCOCC1)CC(=O)NC | 5 |
COC1=C(CNC2=NC=3C(=CC(=CC3C=3N2N=C(N3)C=C)F)OC)C=CC(=C1)OC.FC1(CC(C1)N1N=NC2=C1CCC(C2)(O)C=C)F>ClCCl.CC1=C(C(=CC(=C1)C)C)N1C(N(CC1)C1=C(C=C(C=C1C)C)C)=[Ru](=CC1=C(C=CC=C1)OC(C)C)(Cl)Cl>FC1(CC(C1)N1N=NC2=C1CCC(C2)(O)\C=C\C2=NN1C(=NC=3C(=CC(=CC3C1=N2)F)OC)NCC2=C(C=C(C=C2)OC)OC)F | 3 |
N1=C(C=CC=C1)CN.FC1=C(C=CC(=C1)SC(F)(F)F)N(C(=O)Cl)C>>FC1=C(C=CC(=C1)SC(F)(F)F)N(C(=O)NCC1=NC=CC=C1)C | 5 |
FC(C1=CC=C(CBr)C=C1)(F)F.O=CC1=CC(OC)=C(O)C=C1>>COC=1C=C(C=O)C=CC1OCC1=CC=C(C=C1)C(F)(F)F | 5 |
[O:1]([C:9]1[CH:10]=[C:11]([CH:14]=[CH:15][C:16]=1[O:17][Si:18]([C:21]([CH3:24])([CH3:23])[CH3:22])([CH3:20])[CH3:19])[CH:12]=[O:13])[Si:2]([C:5]([CH3:8])([CH3:7])[CH3:6])([CH3:4])[CH3:3].[N+:25]([CH3:28])([O-:27])=[O:26]>C1COCC1>[O:1]([C:9]1[CH:10]=[C:11]([C@@H:12]([OH:13])[CH2:28][N+:25]([O-:27])=[O:26])[CH:14]=[CH:15][C:16]=1[O:17][Si:18]([C:21]([CH3:24])([CH3:23])[CH3:22])([CH3:19])[CH3:20])[Si:2]([C:5]([CH3:8])([CH3:7])[CH3:6])([CH3:4])[CH3:3] | 1 |
[C:1]12([C:11]3[CH:16]=[CH:15][C:14]([SH:17])=[CH:13][CH:12]=3)[CH2:10][CH:5]3[CH2:6][CH:7]([CH2:9][CH:3]([CH2:4]3)[CH2:2]1)[CH2:8]2.O1CCCC1.[Na].[CH2:24]([O:26][C:27](=[O:32])[CH2:28][CH2:29][CH2:30]Br)[CH3:25]>C(O)C>[CH2:24]([O:26][C:27](=[O:32])[CH2:28][CH2:29][CH2:30][S:17][C:14]1[CH:13]=[CH:12][C:11]([C:1]23[CH2:8][CH:7]4[CH2:9][CH:3]([CH2:4][CH:5]([CH2:6]4)[CH2:10]2)[CH2:2]3)=[CH:16][CH:15]=1)[CH3:25] | 1 |
[Cl:1][C:2]1[CH:3]=[C:4]([NH:9][C:10]2[N:14]=[C:13]([NH2:15])[NH:12][N:11]=2)[CH:5]=[C:6]([Cl:8])[CH:7]=1.ClC1C=C(N=C=S)C=C(Cl)C=1C#N.[F:29][C:30]([F:40])([F:39])[C:31]1[CH:32]=[C:33]([CH:36]=[CH:37][CH:38]=1)[CH:34]=O.[BH4-].[Na+]>CO.O>[Cl:1][C:2]1[CH:3]=[C:4]([NH:9][C:10]2[N:14]=[C:13]([NH:15][CH2:34][C:33]3[CH:36]=[CH:37][CH:38]=[C:31]([C:30]([F:29])([F:39])[F:40])[CH:32]=3)[NH:12][N:11]=2)[CH:5]=[C:6]([Cl:8])[CH:7]=1 | 1 |
COC(C=CN1C=CC2=CC(=CC=C12)CCC=1C(=NC2=NC=CC=C2C1)C)=O>>COC(CCN1C=CC2=CC(=CC=C12)CCC=1C(=NC=2NCCCC2C1)C)=O | 5 |
[Cl:1][C:2]1[CH:3]=[C:4]([CH:18]=[C:19]([Cl:21])[CH:20]=1)[O:5][C:6]1[CH:14]=[CH:13][C:9]([C:10](O)=[O:11])=[CH:8][C:7]=1[N+:15]([O-:17])=[O:16].C1N=C[N:24](C(N2C=NC=C2)=O)C=1.N>C1COCC1.O>[Cl:1][C:2]1[CH:3]=[C:4]([CH:18]=[C:19]([Cl:21])[CH:20]=1)[O:5][C:6]1[CH:14]=[CH:13][C:9]([C:10]([NH2:24])=[O:11])=[CH:8][C:7]=1[N+:15]([O-:17])=[O:16] | 2 |
Cl.Cl.[NH2:3][C:4]1[C:9]([NH2:10])=[CH:8][N:7]=[CH:6][N:5]=1.[CH3:11][O:12][C:13]1[CH:21]=[C:20]([S:22][CH3:23])[CH:19]=[CH:18][C:14]=1[C:15](Cl)=O.P(Cl)(Cl)(Cl)=O>C(O)C>[CH3:11][O:12][C:13]1[CH:21]=[C:20]([S:22][CH3:23])[CH:19]=[CH:18][C:14]=1[C:15]1[NH:10][C:9]2[C:4](=[N:5][CH:6]=[N:7][CH:8]=2)[N:3]=1 | 1 |
[C-]#N.[Zn+2].[C-]#N.COC=1C=C2C(=CC=NC2=CC1OS(=O)(=O)C(F)(F)F)OC1=CC=C(C=C1)[N+](=O)[O-]>N(C)(C)C=O.c1ccc(cc1)[P](c2ccccc2)(c3ccccc3)[Pd]([P](c4ccccc4)(c5ccccc5)c6ccccc6)([P](c7ccccc7)(c8ccccc8)c9ccccc9)[P](c1ccccc1)(c1ccccc1)c1ccccc1>COC=1C=C2C(=CC=NC2=CC1C#N)OC1=CC=C(C=C1)[N+](=O)[O-] | 3 |
ClC=1C=NC=C(C1C(=O)O)F>O.CO[H].ClCCl.ClS(Cl)=O.[Na]>ClC=1C=NC=C(C1C(=O)OC)F | 3 |
[N+](=O)([O-])C=1C=C2CC(COC2=CC1)N(CCC)C(CC)=O>[Zn].C(C)(=O)O>NC=1C=C2CC(COC2=CC1)N(CCC)C(CC)=O | 3 |
Cl.[NH2:2][OH:3].C(=O)([O-])[O-].[Na+].[Na+].[CH3:10][O:11][C:12]1[CH:13]=[C:14]([CH2:18][CH2:19][CH2:20][CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][C:26](Cl)=[O:27])[CH:15]=[CH:16][CH:17]=1.O>C(Cl)Cl>[CH3:10][O:11][C:12]1[CH:13]=[C:14]([CH2:18][CH2:19][CH2:20][CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][C:26]([NH:2][OH:3])=[O:27])[CH:15]=[CH:16][CH:17]=1 | 1 |
[N+](=O)([O-])C1=C(C=C(C=C1)NC(=O)C=1C2CCC(C1)CC2)C(F)(F)F>>[N+](=O)([O-])C1=C(C=C(C=C1)NC(=O)C12C3CCC(C2O1)CC3)C(F)(F)F | 5 |
C(C)(C)(C)N.[I-].C(C)[N+]1(CCC(CC1)=O)C>>C(C)(C)(C)N1CCC(CC1)=O | 5 |
BrCC(=O)NC1CC1.C(C)(C)(C)OC(=O)N1C[C@H]([C@@H](C1)CN(C(C1=CC(=C(C=C1)OC)OCCCOC)=O)C(C)C)N>>C(C)(C)(C)OC(=O)N1C[C@H]([C@@H](C1)CN(C(C1=CC(=C(C=C1)OC)OCCCOC)=O)C(C)C)NCC(NC1CC1)=O | 5 |
Cl[CH2:2][C:3]1[CH:8]=[CH:7][CH:6]=[C:5]([S:9][CH:10]2[CH2:13][CH2:12][CH2:11]2)[N:4]=1.C([O:16][C:17](=[O:28])[CH2:18][CH2:19][C:20]1[CH:25]=[CH:24][C:23]([OH:26])=[C:22]([Cl:27])[CH:21]=1)C>>[Cl:27][C:22]1[CH:21]=[C:20]([CH2:19][CH2:18][C:17]([OH:28])=[O:16])[CH:25]=[CH:24][C:23]=1[O:26][CH2:2][C:3]1[CH:8]=[CH:7][CH:6]=[C:5]([S:9][CH:10]2[CH2:13][CH2:12][CH2:11]2)[N:4]=1 | 1 |
Cl.NCC#N>Cl.O1CCOCC1.C(C(=O)Cl)(=O)Cl>C(#N)CNC(C(=O)Cl)=O | 3 |
O=C1C(CCN(CC1)C(=O)OCC1=CC=CC=C1)C(=O)OCC>O.CCO[H].[OH-].[K+]>O=C1CCN(CCC1)C(=O)OCC1=CC=CC=C1 | 3 |
Br.NC=1C(=C(C=CC1)C=1C=C(SC1)C(=O)O)OC>CO[H].ClCCl.B(Br)(Br)Br>Br.NC=1C(=C(C=CC1)C=1C=C(SC1)C(=O)O)O | 3 |
[F:1][C:2]1[CH:7]=[CH:6][C:5]([C:8]2[S:9][CH:10]=[C:11]([C:13]([CH3:20])([CH3:19])[C:14]([O:16]CC)=[O:15])[N:12]=2)=[CH:4][CH:3]=1.O.[OH-].[Li+]>C1COCC1.C(O)C.O>[F:1][C:2]1[CH:3]=[CH:4][C:5]([C:8]2[S:9][CH:10]=[C:11]([C:13]([CH3:20])([CH3:19])[C:14]([OH:16])=[O:15])[N:12]=2)=[CH:6][CH:7]=1 | 1 |
CS(=O)(=O)OCCN1C(SC=2C=3N(C(=NC21)N)N=C(N3)C=3OC=CC3)=O.FC1=C(C=CC(=C1)[S@@](=O)C)N1CCNCC1>N(C)(C)C=O.O.C(C)(C)N(C(C)C)CC>NC1=NC2=C(C=3N1N=C(N3)C=3OC=CC3)SC(N2CCN2CCN(CC2)C2=C(C=C(C=C2)[S@@](=O)C)F)=O | 3 |
OC1CCNCC1.ClC1=CC=C(C(=N1)C(=O)NC1=C(C=C(C(=O)OC)C=C1C)C)C>>OC1CCN(CC1)C1=CC=C(C(=N1)C(=O)NC1=C(C=C(C(=O)O)C=C1C)C)C | 5 |
[NH2:1]/[C:2](=[N:30]\[S:31]([C:34]1[C:35]([CH3:47])=[C:36]([CH3:46])[C:37]2[O:41][C:40]([CH3:43])([CH3:42])[CH2:39][C:38]=2[C:44]=1[CH3:45])(=[O:33])=[O:32])/[NH:3][CH2:4][CH2:5][CH2:6][C@H:7]([NH:16][S:17]([C:20]1[CH:29]=[CH:28][C:27]2[C:22](=[CH:23][CH:24]=[CH:25][CH:26]=2)[CH:21]=1)(=[O:19])=[O:18])[C:8](=[O:15])[N:9]1[CH2:14][CH2:13][NH:12][CH2:11][CH2:10]1.CCN(C(C)C)C(C)C.Cl[C:58]([O:60][CH2:61][CH3:62])=[O:59]>C(Cl)(Cl)Cl>[CH2:61]([O:60][C:58]([N:12]1[CH2:11][CH2:10][N:9]([C:8](=[O:15])[C@@H:7]([NH:16][S:17]([C:20]2[CH:29]=[CH:28][C:27]3[C:22](=[CH:23][CH:24]=[CH:25][CH:26]=3)[CH:21]=2)(=[O:19])=[O:18])[CH2:6][CH2:5][CH2:4][NH:3]/[C:2](/[NH2:1])=[N:30]/[S:31]([C:34]2[C:35]([CH3:47])=[C:36]([CH3:46])[C:37]3[O:41][C:40]([CH3:43])([CH3:42])[CH2:39][C:38]=3[C:44]=2[CH3:45])(=[O:33])=[O:32])[CH2:14][CH2:13]1)=[O:59])[CH3:62] | 1 |
[Cl:1][C:2]1[S:9][C:8]2/[C:7](=[CH:10]\[C:11]3[CH:16]=[CH:15][CH:14]=[C:13]([Cl:17])[C:12]=3[F:18])/[C:6](=[O:19])[NH:5][C:4]=2[CH:3]=1.[Li+].[OH-].[C:22]([C:24]1[CH:29]=[CH:28][C:27]([NH:30][C:31](=[O:40])[CH2:32]/[N:33]=[CH:34]/[CH2:35][C:36]([CH3:39])([CH3:38])[CH3:37])=[C:26]([O:41][CH3:42])[CH:25]=1)#[N:23]>O1CCCC1>[Cl:1][C:2]1[S:9][C:8]2[C:7]3([CH:10]([C:11]4[CH:16]=[CH:15][CH:14]=[C:13]([Cl:17])[C:12]=4[F:18])[CH:32]([C:31]([NH:30][C:27]4[CH:28]=[CH:29][C:24]([C:22]#[N:23])=[CH:25][C:26]=4[O:41][CH3:42])=[O:40])[NH:33][CH:34]3[CH2:35][C:36]([CH3:39])([CH3:38])[CH3:37])[C:6](=[O:19])[NH:5][C:4]=2[CH:3]=1 | 2 |
BrC=1C=C(C(=O)NCC=2OC(=CC2)C)C=CC1.CC1=NOC(=C1C1=CC=C(N=N1)N)C>O1CCOCC1.C1=CC=C(C=C1)C=CC(=O)C=CC2=CC=CC=C2.C1=CC=C(C=C1)C=CC(=O)C=CC2=CC=CC=C2.C1=CC=C(C=C1)C=CC(=O)C=CC2=CC=CC=C2.[Pd].[Pd].C(=O)([O-])[O-].[Cs+].[Cs+].CC(C)C1=CC(=C(C(=C1)C(C)C)C2=C(C=CC(=C2P(C3CCCCC3)C4CCCCC4)OC)OC)C(C)C>CC1=NOC(=C1C1=CC=C(N=N1)NC=1C=C(C(=O)NCC=2OC(=CC2)C)C=CC1)C | 3 |
C(C1=CC=CC=C1)(=O)N=C=O.CNC(=O)NC1=NC(=NS1)C(Cl)(Cl)Cl>C1=CC=CC=C1.NC(=O)N>C(C1=CC=CC=C1)(=O)NC(=O)N(C(=O)NC1=NC(=NS1)C(Cl)(Cl)Cl)C | 3 |
BrCC1CCCCC1.NC1=NC=CC=C1O>>C1(CCCCC1)COC=1C(=NC=CC1)N | 5 |
NC[C@H](C)N1N=CC(=C1C(=O)OCC)I>Cl.C(O)([O-])=O.[Na+]>IC=1C=NN2C1C(NC[C@@H]2C)=O | 3 |
CN1C(=NC=C1[N+](=O)[O-])C(=N)NNC(=S)N.CN1C(=NC=C1[N+](=O)[O-])C(OCC)=NNC(=S)N>>NC=1SC(=NN1)C=1N(C(=CN1)[N+](=O)[O-])C | 3 |
C(Cl)(=O)C(Cl)=O.CS(C)=O.[Cl:11][CH2:12][CH2:13][O:14][CH2:15][CH:16]([C:18]1[C:26]([F:27])=[CH:25][C:21]2[S:22][CH:23]=[CH:24][C:20]=2[CH:19]=1)[OH:17].Cl>C(Cl)Cl.C(OCC)C.C(OCC)(=O)C.O.C(N(CC)CC)C>[Cl:11][CH2:12][CH2:13][O:14][CH2:15][C:16]([C:18]1[C:26]([F:27])=[CH:25][C:21]2[S:22][CH:23]=[CH:24][C:20]=2[CH:19]=1)=[O:17] | 1 |
BrC=1C=C(C=CC1)C1(COC1)CO>O.C1CCCO1.CCN(CC)CC.CS(=O)(=O)Cl>CS(=O)(=O)OCC1(COC1)C1=CC(=CC=C1)Br | 3 |
C(C1=CC=CC=C1)OC1=CC=C(C=C1)CCC=CCCCCO>c1ccncc1.C1(=CC=C(C=C1)S(=O)(=O)Cl)C>CC1=CC=C(C=C1)S(=O)(=O)OCCCCC=CCCC1=CC=C(C=C1)OCC1=CC=CC=C1 | 3 |
C(C1=CC=CC=C1)N1C(C(=CC2=C(C(=NC(=C12)C=1C=NC=CC1)C(=O)O)O)C1=CC=CC=C1)=O.Cl.COC(CC1(CC1)N)=O>ClCCl.C(C)(C)N(C(C)C)CC.OC1=CC=CC=2NN=NC21.CCN=C=NCCCN(C)C>COC(CC1(CC1)NC(=O)C=1C(=C2C=C(C(N(C2=C(N1)C=1C=NC=CC1)CC1=CC=CC=C1)=O)C1=CC=CC=C1)O)=O | 3 |
[Cl-].[Cl-].[C:3]1([P:9]([C:16]2[CH:21]=[CH:20][CH:19]=[CH:18][CH:17]=2)[C:10]2[CH:15]=[CH:14][CH:13]=[CH:12][CH:11]=2)[CH:8]=[CH:7][CH:6]=[CH:5][CH:4]=1.C(Cl)(Cl)Cl.[H][H]>COCCOC.[C].[Rh]>[C:16]1([P:9]([C:3]2[CH:4]=[CH:5][CH:6]=[CH:7][CH:8]=2)[C:10]2[CH:15]=[CH:14][CH:13]=[CH:12][CH:11]=2)[CH:17]=[CH:18][CH:19]=[CH:20][CH:21]=1 | 1 |
[Br:1][C:2]1[CH:8]=[CH:7][C:5]([NH2:6])=[CH:4][C:3]=1[O:9][CH3:10].[CH3:11][C:12]1([CH3:20])[O:17][C:16](=[O:18])[CH2:15][C:14](=[O:19])[O:13]1.[CH:21](OCC)(OCC)OCC>CCO>[Br:1][C:2]1[CH:8]=[CH:7][C:5]([NH:6][CH:21]=[C:15]2[C:16](=[O:18])[O:17][C:12]([CH3:20])([CH3:11])[O:13][C:14]2=[O:19])=[CH:4][C:3]=1[O:9][CH3:10] | 2 |
BrC1=CC=C(C=C1)S.C(C)(C)(C)OC(=O)N1C([C@@H]([C@@H]1C1=NC=CC=C1F)O[Si](C(C)C)(C(C)C)C(C)C)=O>C([O-])([O-])=O.[K+].[K+].C(C)(C)OC(C)C>C(C)(C)(C)OC(=O)N[C@H]([C@H](C(SC1=CC=C(C=C1)Br)=O)O[Si](C(C)C)(C(C)C)C(C)C)C1=NC=CC=C1F | 3 |
C(C)(C)(C)OC(NCC(CCC1=CC=C(C=C1)C=1N=C(SC1)NC(C)=O)=O)=O>Cl.O1CCOCC1>Cl.NCC(CCC1=CC=C(C=C1)C=1N=C(SC1)NC(C)=O)=O | 3 |
C(C1=CC=CC=C1)OC1=CC=C(C=C1)O.ClC1=C(C=C(N)C=C1)[N+](=O)[O-]>N(C)(C)C=O.[OH-].[K+]>C(C1=CC=CC=C1)OC1=CC=C(OC2=C(C=C(C=C2)N)[N+](=O)[O-])C=C1 | 3 |
COC1=CC=C(CCN)C=C1.NC=1C=CC(=C(C1)C=1C(N(C2=CC(=NC=C2C1)Cl)C)=O)Cl>>COC1=CC=C(CN(C2=NC=C3C=C(C(N(C3=C2)C)=O)C2=C(C=CC(=C2)N)Cl)C)C=C1 | 5 |
C[Si](C)(C)C=[N+]=[N-].BrC=1C=C(C=C(C1)Br)CC(=O)O>C1(=CC=CC=C1)C.CO[H]>COC(CC1=CC(=CC(=C1)Br)Br)=O | 3 |
Cl[C:2]1[N:7]=[C:6]([O:8][C:9]2[C:14]3[N:15]=[C:16]([NH2:18])[S:17][C:13]=3[CH:12]=[CH:11][CH:10]=2)[CH:5]=[C:4]([C:19]2[CH:24]=[CH:23][C:22]([C:25]([F:28])([F:27])[F:26])=[CH:21][CH:20]=2)[N:3]=1.[F:29][C:30]1[CH:38]=[CH:37][C:33]([CH:34]([NH2:36])[CH3:35])=[CH:32][CH:31]=1>>[F:29][C:30]1[CH:38]=[CH:37][C:33]([CH:34]([NH:36][C:2]2[N:7]=[C:6]([O:8][C:9]3[C:14]4[N:15]=[C:16]([NH2:18])[S:17][C:13]=4[CH:12]=[CH:11][CH:10]=3)[CH:5]=[C:4]([C:19]3[CH:20]=[CH:21][C:22]([C:25]([F:27])([F:28])[F:26])=[CH:23][CH:24]=3)[N:3]=2)[CH3:35])=[CH:32][CH:31]=1 | 2 |
NC1=NC=CC2=C1N=C(N2CCCC(=O)OCC)SC2=CC1=C(OCO1)C=C2I>CO[H].N>NC1=NC=CC2=C1N=C(N2CCCC(=O)N)SC2=CC1=C(OCO1)C=C2I | 3 |
C(=S)(Cl)Cl.NC=1C=C(C=CC1O)S(=O)(=O)N>C1CCCO1>SC=1OC2=C(N1)C=C(C=C2)S(=O)(=O)N | 3 |
C(#N)C=1C=C(C(=O)Cl)C=CC1.[S-]C#N.[Na+]>C(C)(=O)OCC>C(#N)C=1C=C(C(=O)N=C=S)C=CC1 | 3 |
BrCC1=C(C=C(C#N)C=C1)Cl.CC1=NC2=C(N1)C=C(C=C2C)OCC2=C(C(=O)OC)C=CC=C2>>ClC1=C(CN2C(=NC3=C2C=C(C=C3C)OCC3=C(C(=O)OC)C=CC=C3)C)C=CC(=C1)C#N | 5 |
COC=1C=C(C=CC1)C(C(=O)C1=CC(=CC=C1)OC)=O>CCO[H].O.NN.C(C)(=O)O>COC=1C=C(C=CC1)C(C(=O)C1=CC(=CC=C1)OC)=NN | 3 |
OCCN1CCNCC1.C(C)(C)(C)C1=CC(=NO1)NC(=O)NC1=CC(=CC=C1)OC1=NC=NC2=CC(=C(C=C12)OC)OCCCCl>N(C)(C)C=O.C(C)(C)N(C(C)C)CC.[I-].C(CCC)[N+](CCCC)(CCCC)CCCC>C(C)(C)(C)C1=CC(=NO1)NC(=O)NC1=CC(=CC=C1)OC1=NC=NC2=CC(=C(C=C12)OC)OCCCN1CCN(CC1)CCO | 3 |
[CH2:1]([CH:3]([CH2:16][CH2:17][CH2:18][CH3:19])[CH2:4][O:5][C:6]1[CH:14]=[CH:13][C:9]([C:10]([OH:12])=O)=[C:8]([OH:15])[CH:7]=1)[CH3:2].C(OC(=O)C)(=O)C.Cl.C(Cl)Cl.[N:31]1C=CC=[CH:33][CH:32]=1>>[CH2:32]([NH:31][C:10](=[O:12])[C:9]1[CH:13]=[CH:14][C:6]([O:5][CH2:4][CH:3]([CH2:1][CH3:2])[CH2:16][CH2:17][CH2:18][CH3:19])=[CH:7][C:8]=1[OH:15])[CH3:33] | 1 |
[CH3:1][C:2]1[C:11]2[C:6](=[CH:7][CH:8]=[CH:9][CH:10]=2)[C:5]([S:12](Cl)(=[O:14])=[O:13])=[CH:4][CH:3]=1.[CH:16]1([NH2:22])[CH2:21][CH2:20][CH2:19][CH2:18][CH2:17]1.C(N(CC)CC)C>C(Cl)Cl>[CH:16]1([NH:22][S:12]([C:5]2[C:6]3[C:11](=[CH:10][CH:9]=[CH:8][CH:7]=3)[C:2]([CH3:1])=[CH:3][CH:4]=2)(=[O:14])=[O:13])[CH2:21][CH2:20][CH2:19][CH2:18][CH2:17]1 | 1 |
C(C)(C)(C)OC(=O)N(C=1C(=C(C(=O)OCC)C=CC1C(F)(F)F)Cl)OC>O.C1CCCO1.[OH-].[Li+]>C(C)(C)(C)OC(=O)N(C=1C(=C(C(=O)O)C=CC1C(F)(F)F)Cl)OC | 3 |
C(=O)=O.C(\C=C/C(=O)O)(=O)O>O.C(=O)([O-])[O-].[Ca+2]>C(\C=C/C(=O)[O-])(=O)[O-].[Ca+2] | 3 |
[N:1]1([CH2:6][CH2:7][N:8]2[C:16]3[C:11](=[CH:12][CH:13]=[C:14]([NH2:17])[CH:15]=3)[CH:10]=[N:9]2)[CH2:5][CH2:4][CH2:3][CH2:2]1.[C:18]1([C:31]2[CH:36]=[CH:35][CH:34]=[CH:33][CH:32]=2)[CH:23]=[CH:22][C:21]([C:24](=[O:30])[CH2:25][CH2:26][C:27](O)=[O:28])=[CH:20][CH:19]=1>>[C:18]1([C:31]2[CH:32]=[CH:33][CH:34]=[CH:35][CH:36]=2)[CH:23]=[CH:22][C:21]([C:24](=[O:30])[CH2:25][CH2:26][C:27]([NH:17][C:14]2[CH:15]=[C:16]3[C:11]([CH:10]=[N:9][N:8]3[CH2:7][CH2:6][N:1]3[CH2:5][CH2:4][CH2:3][CH2:2]3)=[CH:12][CH:13]=2)=[O:28])=[CH:20][CH:19]=1 | 1 |
ClC1=CC=C2C(=N1)N(C=C2B(O)O)COCC[Si](C)(C)C.BrC=1C=C2C(=NC1OC)SC=N2>O.C([O-])([O-])=O.[K+].[K+].O1CCOCC1.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.Cl[Pd]Cl.[Fe+2]>ClC1=CC=C2C(=N1)N(C=C2C=2C=C1C(=NC2OC)SC=N1)COCC[Si](C)(C)C | 3 |
CC(C)(O)C1=CC(=C(C=C1)N(C(C)=O)S(=O)(=O)C1=CC=CC=C1)OC>>COC1=C(C=CC(=C1)C(C)C)N(C(C)=O)S(=O)(=O)C1=CC=CC=C1 | 5 |
C1(CC1)COC=1C=C(C=CC1OC(F)F)C1=CC(=C(N1)COCC1=CC=C(C=C1)OC)C(=O)OCC>>C1(CC1)COC=1C=C(C=CC1OC(F)F)C1=CC(=C(N1)C=O)C(=O)OCC | 5 |
ClC=1C(=C(C=CC1)B(O)O)Cl.BrC1=C(C=C(C(=N1)C(=O)OC)N1CCC2([C@@H]([C@@H](OC2)C)NC(=O)OC(C)(C)C)CC1)OCC1=CC=C(C=C1)OC>O.C([O-])([O-])=O.[Na+].[Na+].COCCOC.c1ccc(cc1)[P](c2ccccc2)(c3ccccc3)[Pd]([P](c4ccccc4)(c5ccccc5)c6ccccc6)([P](c7ccccc7)(c8ccccc8)c9ccccc9)[P](c1ccccc1)(c1ccccc1)c1ccccc1>C(C)(C)(C)OC(=O)N[C@@H]1[C@@H](OCC12CCN(CC2)C=2C(=NC(=C(C2)OCC2=CC=C(C=C2)OC)C2=C(C(=CC=C2)Cl)Cl)C(=O)OC)C | 3 |
C(C)N.FC=1C=C(C=CC1[N+](=O)[O-])SC1=NN=C2N1N=C(C=C2)C=2C=NN(C2)C>C1CCCO1.[Fe]>C(C)N1C=NC2=C1C=C(C=C2)SC2=NN=C1N2N=C(C=C1)C=1C=NN(C1)C | 3 |
[O:1]=[C:2]([CH3:25])[CH:3](C(OCC)=O)[CH2:4][CH2:5][CH2:6][CH2:7][CH2:8][N:9]1[C:13](=[O:14])[C:12]2=[CH:15][CH:16]=[CH:17][CH:18]=[C:11]2[C:10]1=[O:19].C(O)(=O)C.Cl.O>C(Cl)Cl.[OH-].[Na+]>[O:1]=[C:2]([CH3:25])[CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][CH2:8][N:9]1[C:13](=[O:14])[C:12]2=[CH:15][CH:16]=[CH:17][CH:18]=[C:11]2[C:10]1=[O:19] | 1 |
C(C(C)C)[Mg]Cl.OC1=NC=C(C(=O)N(C)OC)C=C1>>OC1=NC=C(C=C1)C(CC(C)C)=O | 5 |
C(C)(=O)OC(C)=O.BrC1=CC=C(C=C1)C(CCN)C>>BrC1=CC=C(C=C1)C(CCNC(C)=O)C | 5 |
[C:1]([C:4]1[C:9]([C:10]2[CH:15]=[CH:14][CH:13]=[CH:12][CH:11]=2)=[N:8][N:7]([CH2:16][CH3:17])[C:6](=[O:18])[C:5]=1[N+:19]([O-])=O)(=[O:3])[CH3:2].N[C:23]1[CH:32]=[CH:31][CH:30]=[C:29]2[C:24]=1[CH:25]=[CH:26][C:27]([CH3:33])=[N:28]2>C(O)C>[C:1]([C:4]1[C:9]([C:10]2[CH:15]=[CH:14][CH:13]=[CH:12][CH:11]=2)=[N:8][N:7]([CH2:16][CH3:17])[C:6](=[O:18])[C:5]=1[NH:19][C:23]1[CH:32]=[CH:31][CH:30]=[C:29]2[C:24]=1[CH:25]=[CH:26][C:27]([CH3:33])=[N:28]2)(=[O:3])[CH3:2] | 1 |
ClCC=1N=C(SC1)C1=CC=C(C=C1)Cl.OCCOC1=CC=C(C=C1)C1=C(C(=NC(=C1C#N)S)OC)C#N>>ClC1=CC=C(C=C1)C=1SC=C(N1)CSC1=NC(=C(C(=C1C#N)C1=CC=C(C=C1)OCCO)C#N)OC | 5 |
O1C(C=CCC1)=O.BrC1=C(C=CC=C1)B(O)O>O.Cl.O1CCOCC1.[OH-].[K+].Cl[Rh].Cl[Rh].C1CC=CCCC=C1.C2CC=CCCC=C2>BrC1=C(C=CC=C1)C1CC(OCC1)=O | 3 |
[CH2:1]([O:3][C:4]([OH:16])=[C:5]1[C:13]2[C:8](=[CH:9][CH:10]=[CH:11][CH:12]=2)[C:7]([C:14]#[N:15])=[CH:6]1)[CH3:2].[Na].C(O)=O>C(O)C.[Pd]>[CH2:1]([O:3][C:4]([CH:5]1[C:13]2[C:8](=[CH:9][CH:10]=[CH:11][CH:12]=2)[CH:7]([C:14]#[N:15])[CH2:6]1)=[O:16])[CH3:2] | 1 |
Cl.[Si]([O:9][CH2:10][C:11]1[CH:12]=[C:13]2[C:18](=[N:19][C:20]=1[CH:21](OC)[O:22]C)[N:17]([C:26]([NH:28][C:29]1[CH:34]=[C:33]([NH:35][CH2:36][C:37]([OH:40])([CH3:39])[CH3:38])[C:32]([C:41]#[N:42])=[CH:31][N:30]=1)=[O:27])[CH2:16][CH2:15][CH2:14]2)(C(C)(C)C)(C)C.C([O-])(O)=O.[Na+]>C1COCC1.O>[C:41]([C:32]1[C:33]([NH:35][CH2:36][C:37]([OH:40])([CH3:38])[CH3:39])=[CH:34][C:29]([NH:28][C:26]([N:17]2[C:18]3[C:13](=[CH:12][C:11]([CH2:10][OH:9])=[C:20]([CH:21]=[O:22])[N:19]=3)[CH2:14][CH2:15][CH2:16]2)=[O:27])=[N:30][CH:31]=1)#[N:42] | 1 |
BrC=1C(=C(CN2CC(C2)C(=O)OC)C=CC1)CC>O1CCOCC1.B1(OC(C(O1)(C)C)(C)C)B2OC(C(O2)(C)C)(C)C.C(C)(=O)[O-].[K+].ClCCl.[Pd](Cl)Cl.C1(=CC=CC=C1)P(C1=CC=CC=C1)[C-]1C=CC=C1.[CH-]1C=CC=C1.[Fe+2].C1(=CC=CC=C1)P(C1=CC=CC=C1)[C-]1C=CC=C1.[CH-]1C=CC=C1.[Fe+2]>C(C)C1=C(CN2CC(C2)C(=O)OC)C=CC=C1B1OC(C(O1)(C)C)(C)C | 3 |
CC=1SC=C(N1)C(=O)OCC>>BrCC=1SC=C(N1)C(=O)OCC | 5 |
NC=1C2=C(N=CN1)N(C(=C2C2=CC=C(C=C2)OC2=CC=CC=C2)F)[C@H]2CN(CC2)C(=O)OC(C)(C)C>CO[H].C[O-].[Na+]>NC=1C2=C(N=CN1)N(C(=C2C2=CC=C(C=C2)OC2=CC=CC=C2)OC)[C@H]2CN(CC2)C(=O)OC(C)(C)C | 3 |
ClC=1N=[N+](C2=C(N1)C=CC=C2)[O-].NCCCC#N>>[O-][N+]1=NC(=NC2=C1C=CC=C2)NCCCC#N | 5 |
[CH3:1][C:2]1[CH:19]=[CH:18][C:5]([C:6]([NH:8][C:9]2[S:10][C:11]3[CH2:17][CH2:16][CH2:15][CH2:14][C:12]=3[N:13]=2)=[O:7])=[CH:4][CH:3]=1.Br[CH:21]([CH3:27])[C:22]([O:24]CC)=[O:23].S1C2C=CC=CC=2N=C1NC(=O)C1C=CC(C(F)(F)F)=CC=1.BrCC(OCC)=O>>[CH3:1][C:2]1[CH:3]=[CH:4][C:5]([C:6]([N:8]=[C:9]2[N:13]([CH:21]([CH3:27])[C:22]([OH:24])=[O:23])[C:12]3[CH2:14][CH2:15][CH2:16][CH2:17][C:11]=3[S:10]2)=[O:7])=[CH:18][CH:19]=1 | 2 |
FC1=C(CN2C=CC=3C2=CN=C(C3)C(=O)OCC)C=CC(=C1)F>O.CO[H].[OH-].[Na+]>FC1=C(CN2C=CC=3C2=CN=C(C3)C(=O)O)C=CC(=C1)F | 3 |
ClC1=C(C(=NC=N1)N)C1=NOC(=C1)[Si](C)(C)C>>ClC1=C(C(=NC=N1)N)C1=NOC=C1 | 5 |
[C:1]([C:3]1([C:13]2[CH:18]=[CH:17][C:16]([O:19][CH3:20])=[C:15]([O:21][CH:22]3[CH2:26][CH2:25][CH2:24][CH2:23]3)[CH:14]=2)[CH2:8][CH2:7][C:6]([C:9]([O:11]C)=[O:10])=[CH:5][CH2:4]1)#[N:2].O1CCCC1.[OH-].[K+]>CO.O>[C:1]([C:3]1([C:13]2[CH:18]=[CH:17][C:16]([O:19][CH3:20])=[C:15]([O:21][CH:22]3[CH2:26][CH2:25][CH2:24][CH2:23]3)[CH:14]=2)[CH2:8][CH2:7][C:6]([C:9]([OH:11])=[O:10])=[CH:5][CH2:4]1)#[N:2] | 1 |
[C:1]([O:5][C:6]([N:8]([C:23]([O:25][C:26]([CH3:29])([CH3:28])[CH3:27])=[O:24])[C:9]1[O:17][C:16]2[C:11](=[N:12][CH:13]=[C:14](Br)[CH:15]=2)[C:10]=1[C:19]([O:21][CH3:22])=[O:20])=[O:7])([CH3:4])([CH3:3])[CH3:2].[O-]P([O-])([O-])=O.[K+].[K+].[K+].O1CCO[CH2:40][CH2:39]1.CC1(C)C(C)(C)OB(C=C)O1>C1(P(C2CCCCC2)C2C=CC=CC=2C2C(C(C)C)=CC(C(C)C)=CC=2C(C)C)CCCCC1.NC1C=CC=CC=1C1C=CC=CC=1[Pd]Cl.O>[C:1]([O:5][C:6]([N:8]([C:23]([O:25][C:26]([CH3:29])([CH3:28])[CH3:27])=[O:24])[C:9]1[O:17][C:16]2[C:11](=[N:12][CH:13]=[C:14]([CH:39]=[CH2:40])[CH:15]=2)[C:10]=1[C:19]([O:21][CH3:22])=[O:20])=[O:7])([CH3:4])([CH3:3])[CH3:2] | 2 |
BrCC(=O)OC(C)(C)C.O=C1NC=2N(C(=C1CC1=CC=C(C=C1)C=1C(=CC=CC1)C#N)CCC)N=CN2>>C(#N)C1=C(C=CC=C1)C1=CC=C(C=C1)CC=1C(N(C=2N(C1CCC)N=CN2)CC(=O)OC(C)(C)C)=O | 5 |
CC1=C(C=C(N)C=C1)B1OC(C(O1)(C)C)(C)C.BrC1=CC=C2C=C(N=CC2=C1)NC(=O)C1CC1>>NC=1C=CC(=C(C1)C1=CC=C2C=C(N=CC2=C1)NC(=O)C1CC1)C | 5 |
S(=O)(=O)(OC)OC.C(=O)(O)C=1C=C(OC2=CC=C(C=C2)[N+](=O)[O-])C=CC1O.OC1=C(C(=O)O)C=C(C=C1)O>C([O-])([O-])=O.[K+].[K+].CC(=O)C>COC(=O)C=1C=C(OC2=CC=C(C=C2)[N+](=O)[O-])C=CC1OC | 3 |
C(C)(C)(C)C1=C(C(=NC=C1)C)C>ClCCl.C([O-])([O-])=O.[Na+].[Na+].ClC=1C=C(C(=O)OO)C=CC1>C(C)(C)(C)C1=C(C(=[N+](C=C1)[O-])C)C | 3 |
Cl[CH2:2][C:3]1[N:4]=[C:5]([C:9]2[CH:18]=[CH:17][C:16]3[C:11](=[CH:12][CH:13]=[CH:14][CH:15]=3)[CH:10]=2)[O:6][C:7]=1[CH3:8].[I-:19].[Na+].C(OC)(C)(C)C>CC(C)=O>[I:19][CH2:2][C:3]1[N:4]=[C:5]([C:9]2[CH:18]=[CH:17][C:16]3[C:11](=[CH:12][CH:13]=[CH:14][CH:15]=3)[CH:10]=2)[O:6][C:7]=1[CH3:8] | 1 |
[CH:1]1[C:14]2[C:13]3[C:8](=[CH:9][CH:10]=[CH:11][CH:12]=3)[CH2:7][NH:6][C:5]=2[CH:4]=[CH:3][CH:2]=1.[CH3:15][C:16]1[CH:33]=[CH:32][CH:31]=[CH:30][C:17]=1[C:18]([NH:20][C:21]1[CH:29]=[CH:28][C:24]([C:25](Cl)=[O:26])=[CH:23][CH:22]=1)=[O:19]>N1C=CC=CC=1>[CH3:15][C:16]1[CH:33]=[CH:32][CH:31]=[CH:30][C:17]=1[C:18]([NH:20][C:21]1[CH:29]=[CH:28][C:24]([C:25]([N:6]2[CH2:7][C:8]3[C:13](=[CH:12][CH:11]=[CH:10][CH:9]=3)[C:14]3[CH:1]=[CH:2][CH:3]=[CH:4][C:5]2=3)=[O:26])=[CH:23][CH:22]=1)=[O:19] | 1 |
[CH3:1][O:2][C:3]1[CH:4]=[C:5]([NH:15][C:16]2[N:21]=[C:20]([C:22](=[O:24])[CH3:23])[CH:19]=[C:18]([CH2:25][O:26][CH3:27])[N:17]=2)[CH:6]=[CH:7][C:8]=1[N:9]1[CH:13]=[C:12]([CH3:14])[N:11]=[CH:10]1.[CH3:28][Mg]Br>O1CCCC1>[CH3:1][O:2][C:3]1[CH:4]=[C:5]([NH:15][C:16]2[N:21]=[C:20]([C:22]([OH:24])([CH3:28])[CH3:23])[CH:19]=[C:18]([CH2:25][O:26][CH3:27])[N:17]=2)[CH:6]=[CH:7][C:8]=1[N:9]1[CH:13]=[C:12]([CH3:14])[N:11]=[CH:10]1 | 1 |
C(C=C)[C@@]1(C(N([C@@H]([C@H](C1)C1=CC(=CC=C1)Cl)C1=CC=C(C=C1)Cl)[C@H](CN(S(=O)(=O)C1CC1)C)CC)=O)CO>ClCCl.CCN(CC)CC.CS(=O)(=O)Cl>CS(=O)(=O)OC[C@]1(C(N([C@@H]([C@H](C1)C1=CC(=CC=C1)Cl)C1=CC=C(C=C1)Cl)[C@H](CN(S(=O)(=O)C1CC1)C)CC)=O)CC=C | 3 |
COC(=O)C1CC(C=2C=CC(=NC2C1)C(F)(F)F)=O>>COC(=O)C1=CC(=C2C=CC(=NC2=C1)C(F)(F)F)O | 5 |
[C:1]([O-:4])(=[S:3])[CH3:2].[K+].CC1C=CC(S(O[CH2:17][CH:18]2[CH2:22][O:21][C:20]3([CH2:26][CH2:25][CH:24]([CH2:27][C:28]([O:30][CH2:31][CH3:32])=[O:29])[CH2:23]3)[O:19]2)(=O)=O)=CC=1>CC(C)=O>[C:1]([S:3][CH2:17][CH:18]1[CH2:22][O:21][C:20]2([CH2:26][CH2:25][CH:24]([CH2:27][C:28]([O:30][CH2:31][CH3:32])=[O:29])[CH2:23]2)[O:19]1)(=[O:4])[CH3:2] | 1 |
FC=1N=CN2C1SC=C2>C1CCCO1.C(CCC)[Sn](CCCC)(CCCC)Cl.C[Si](C)(C)[N-][Si](C)(C)C.[Li+].C1CCOC1>FC=1N=CN2C1SC(=C2)[Sn](CCCC)(CCCC)CCCC | 3 |
C(C)(C)(C)N.ClS(=O)(=O)C1=CC(=C(C(=O)OC)C=C1)Cl>ClCCl.C(C)(C)N(C(C)C)CC>C(C)(C)(C)NS(=O)(=O)C1=CC(=C(C(=O)OC)C=C1)Cl | 3 |
Br[C:2]1[CH:7]=[CH:6][CH:5]=[CH:4][N:3]=1.[N:8]([CH2:11][CH2:12][CH2:13][CH2:14][N:15]=[N+:16]=[N-:17])=[N+:9]=[N-:10].[NH4+:18]>CCCCC.CCCCCC>[N:3]1[CH:4]=[CH:5][CH:6]=[CH:7][C:2]=1[NH:10][N:9]=[N:8][CH2:11][CH2:12][CH2:13][CH2:14][N:15]=[N:16][NH:17][C:2]1[CH:7]=[CH:6][CH:5]=[CH:4][N:18]=1 | 1 |
Br.[NH:2]([C:4]1[NH:5][CH2:6][CH2:7][N:8]=1)[NH2:3].[OH:9][C:10]1[CH:17]=[C:16]([OH:18])[C:15]([OH:19])=[CH:14][C:11]=1[CH:12]=O>>[NH:8]1[CH2:7][CH2:6][N:5]=[C:4]1[NH:2][N:3]=[CH:12][C:11]1[CH:14]=[C:15]([OH:19])[C:16]([OH:18])=[CH:17][C:10]=1[OH:9] | 2 |
[CH3:1][NH:2][C:3]1[S:4][CH:5]=[C:6]([CH3:16])[C:7]=1[C:8](=O)[C:9]1[CH:14]=[CH:13][CH:12]=[CH:11][CH:10]=1.[C:17](=O)([O:19]CC)[NH2:18]>[Cl-].[Zn+2].[Cl-]>[CH3:1][N:2]1[C:3]2[S:4][CH:5]=[C:6]([CH3:16])[C:7]=2[C:8]([C:9]2[CH:14]=[CH:13][CH:12]=[CH:11][CH:10]=2)=[N:18][C:17]1=[O:19] | 1 |
Cl.Cl.[F:3][C:4]1[CH:12]=[C:11]([C:13]2[CH:14]=[N:15][C:16]3[N:17]([C:19]([CH2:22][C:23]4[CH:24]=[C:25]5[C:30](=[CH:31][CH:32]=4)[N:29]=[CH:28][CH:27]=[CH:26]5)=[CH:20][N:21]=3)[N:18]=2)[CH:10]=[CH:9][C:5]=1[C:6](O)=[O:7].S(Cl)(Cl)=O.[CH3:37][NH2:38].C(=O)([O-])[O-].[Na+].[Na+]>C1COCC1.O.C1(C)C=CC=CC=1>[F:3][C:4]1[CH:12]=[C:11]([C:13]2[CH:14]=[N:15][C:16]3[N:17]([C:19]([CH2:22][C:23]4[CH:24]=[C:25]5[C:30](=[CH:31][CH:32]=4)[N:29]=[CH:28][CH:27]=[CH:26]5)=[CH:20][N:21]=3)[N:18]=2)[CH:10]=[CH:9][C:5]=1[C:6]([NH:38][CH3:37])=[O:7] | 1 |
N1=CN=C2N=CNC2=C1N.C1=C(C=CS1)C(=O)Cl>c1ccncc1>C1=C(C=CS1)C(=O)NC1=C2NC=NC2=NC=N1 | 3 |
CC=1C(=NC=CC1OCC(F)(F)F)CSC1=NC2=C(N1)C=CC=C2>CO[H].C(C)(=O)O.C(=O)([O-])[O-].C(=O)([O-])[O-].OO.OO.OO.[Na+].[Na+].[Na+].[Na+].[NH4+].[NH4+].[O-][Mo](=O)(=O)[O-]>CC=1C(=CC=NC1C[S+](C=2NC=3C=CC=CC3N2)[O-])OCC(F)(F)F | 3 |
CC(C)(C)[S@@](=O)N[C@@H](C)C1CCOCC1>>O1CCC(CC1)[C@H](C)N | 5 |
Subsets and Splits
No community queries yet
The top public SQL queries from the community will appear here once available.