smiles stringlengths 15 6.12k | source_id int64 1 5 |
|---|---|
C(C)(C)(C)OC(=O)N1CC(N(CC1)C)=O>ClCCl.C(=O)(C(F)(F)F)O>FC(C(=O)O)(F)F.CN1C(CNCC1)=O | 3 |
FC(OC=1C=C2C(=CC1)N(C(C21CCN(CC1)C(=O)OC(C)(C)C)=O)COCC[Si](C)(C)C)F>CO[H].ClCCl.C(=O)(C(F)(F)F)O>FC(OC=1C=C2C(=CC1)NC(C21CCNCC1)=O)F | 3 |
C[S-].[Na+].FC=1C(=C(C(=O)O)C=CC1C(F)(F)F)C>N(C)(C)C=O.[H-].[Na+]>CC1=C(C(=O)O)C=CC(=C1SC)C(F)(F)F | 3 |
BrCCO.CC1(OB(OC1(C)C)C=1C=NNC1)C>N(C)(C)C=O.C(=O)([O-])[O-].[Cs+].[Cs+]>CC1(OB(OC1(C)C)C=1C=NN(C1)CCO)C | 3 |
Cl.[Cl:2][C:3]1[CH:12]=[C:11]2[C:6]([C:7]([NH:13][C:14]3[CH:19]=[CH:18][C:17]([S:20](Cl)(=[O:22])=[O:21])=[CH:16][CH:15]=3)=[CH:8][CH:9]=[N:10]2)=[CH:5][CH:4]=1.[NH2:24][CH:25]1[CH2:30][CH2:29][N:28]([CH2:31][CH2:32][CH2:33][CH3:34])[CH2:27][CH2:26]1.C(=O)([O-])[O-].[Na+].[Na+]>O.C(Cl)(Cl)Cl>[Cl:2][C:3]1[CH:12]=[C:11]2[C:6]([C:7]([NH:13][C:14]3[CH:19]=[CH:18][C:17]([S:20]([NH:24][CH:25]4[CH2:30][CH2:29][N:28]([CH2:31][CH2:32][CH2:33][CH3:34])[CH2:27][CH2:26]4)(=[O:22])=[O:21])=[CH:16][CH:15]=3)=[CH:8][CH:9]=[N:10]2)=[CH:5][CH:4]=1 | 1 |
C(C=C)Br.[Si](C1=CC=CC=C1)(C1=CC=CC=C1)(C(C)(C)C)OC[C@H](CC)N1C(C(C[C@@H]([C@H]1C1=CC=C(C=C1)Cl)C1=CC(=CC=C1)Cl)CC)=O>>C(C=C)C1(C(N([C@@H]([C@H](C1)C1=CC(=CC=C1)Cl)C1=CC=C(C=C1)Cl)[C@H](CO)CC)=O)CC | 5 |
C(C1=CC=CC=C1)O.O=C1CC(CN1C=1C=CC=2OCC(NC2N1)=O)C(=O)O>CCN(CC)CC.C1=CC=CC=C1.C1=CC=C(C=C1)OP(=O)(N=[N+]=[N-])OC2=CC=CC=C2>C(C1=CC=CC=C1)OC(NC1CN(C(C1)=O)C=1C=CC=2OCC(NC2N1)=O)=O | 3 |
[C:1]([O:5][C:6]([N:8]1[CH2:12][CH2:11][CH:10]([O:13][CH2:14][C:15]2[CH:20]=[CH:19][CH:18]=[CH:17][CH:16]=2)[CH:9]1[CH2:21][CH:22]([OH:35])[CH2:23][N:24]1[C:29](=[O:30])[C:28]2[N:31]=[CH:32][CH:33]=[CH:34][C:27]=2[N:26]=[CH:25]1)=[O:7])([CH3:4])([CH3:3])[CH3:2].C[N+]1([O-])CCOCC1>[Ru]([O-])(=O)(=O)=O.C([N+](CCC)(CCC)CCC)CC.C(Cl)Cl>[C:1]([O:5][C:6]([N:8]1[CH2:12][CH2:11][CH:10]([O:13][CH2:14][C:15]2[CH:16]=[CH:17][CH:18]=[CH:19][CH:20]=2)[CH:9]1[CH2:21][C:22](=[O:35])[CH2:23][N:24]1[C:29](=[O:30])[C:28]2[N:31]=[CH:32][CH:33]=[CH:34][C:27]=2[N:26]=[CH:25]1)=[O:7])([CH3:4])([CH3:2])[CH3:3] | 2 |
[C:1]1([CH2:7][C:8]([NH2:10])=[O:9])[CH:6]=[CH:5][CH:4]=[CH:3][CH:2]=1.[Br:11]N1C(=O)CCC1=O.O>ClCCl>[Br:11][CH:7]([C:1]1[CH:6]=[CH:5][CH:4]=[CH:3][CH:2]=1)[C:8]([NH2:10])=[O:9] | 1 |
ClC=1C(=C(C=CC1)\C=C(/F)\C=1N(C2=C(CNCC2)N1)C)C>ClCCl.CCN(CC)CC.CC(=O)C.C(C)(=O)O[BH-](OC(C)=O)OC(C)=O.[Na+]>ClC=1C(=C(C=CC1)\C=C(/F)\C=1N(C2=C(CN(CC2)C(C)C)N1)C)C | 3 |
CC=1C=C(N)C=C(C1)C.CS(=O)(=O)C1=NC=CC(=N1)C=1N=CSC1C#N.CS(=O)C1=NC=CC(=N1)C=1N=CSC1C#N>>CC=1C=C(C=C(C1)C)NC1=NC=CC(=N1)C=1N=CSC1C#N | 5 |
[C:1]([N:4]1[CH2:13][CH2:12][C:11]2[C:6](=[C:7]([Cl:15])[C:8]([SH:14])=[CH:9][CH:10]=2)[CH2:5]1)(=O)[CH3:2].B#B.O>O1CCCC1>[ClH:15].[Cl:15][C:7]1[C:8]([SH:14])=[CH:9][CH:10]=[C:11]2[C:6]=1[CH2:5][N:4]([CH2:1][CH3:2])[CH2:13][CH2:12]2 | 1 |
ClC=1C(=NC=CN1)C(=O)O.C(C)NC(=O)NC1=CC=C(C=C1)C=1N=C(C2=C(N1)CNCC2)N2CCOCC2>N(C)(C)C=O.ClCCl.C(C(=O)Cl)(=O)Cl.C(C)(C)N(C(C)C)CC>ClC=1C(=NC=CN1)C(=O)N1CC=2N=C(N=C(C2CC1)N1CCOCC1)C1=CC=C(C=C1)NC(=O)NCC | 3 |
C(CC)(=O)OCC.CON(C(=O)C1=NOC=C1)C>C1CCCO1.Cl.C[Si](C)(C)[N-][Si](C)(C)C.[Na+]>O1N=C(C=C1)C(C=C(C(=O)OCC)N(C)OC)=O | 3 |
[CH2:1]([O:3][C:4]1[CH:23]=[CH:22][C:7]([CH2:8][O:9][C:10]2[CH:11]=[CH:12][C:13]3[O:17][C:16]([C:18](=[O:20])[CH3:19])=[CH:15][C:14]=3[CH:21]=2)=[CH:6][CH:5]=1)[CH3:2].[BH4-].[Na+].O>CO>[CH2:1]([O:3][C:4]1[CH:23]=[CH:22][C:7]([CH2:8][O:9][C:10]2[CH:11]=[CH:12][C:13]3[O:17][C:16]([CH:18]([OH:20])[CH3:19])=[CH:15][C:14]=3[CH:21]=2)=[CH:6][CH:5]=1)[CH3:2] | 1 |
[CH2:1]([O:8][CH2:9][CH2:10][CH2:11][CH2:12][OH:13])[C:2]1[CH:7]=[CH:6][CH:5]=[CH:4][CH:3]=1.[H-].[Na+].Cl[C:17]1[N:22]=[C:21]([NH:23][C:24](=[O:29])[C:25]([CH3:28])([CH3:27])[CH3:26])[C:20]([CH:30]=[O:31])=[CH:19][CH:18]=1.[NH4+].[Cl-]>CN(C=O)C.CCOC(C)=O>[CH2:1]([O:8][CH2:9][CH2:10][CH2:11][CH2:12][O:13][C:17]1[N:22]=[C:21]([NH:23][C:24](=[O:29])[C:25]([CH3:26])([CH3:27])[CH3:28])[C:20]([CH:30]=[O:31])=[CH:19][CH:18]=1)[C:2]1[CH:7]=[CH:6][CH:5]=[CH:4][CH:3]=1 | 2 |
C(C1=CC=CC=C1)N1CCC(CC1)(C#N)C=1C(=NC(=CC1)Cl)Cl.[H-].CC(C)(C)[O-].CC(C)(C)[O-].CC(C)(C)[O-].[Li+].[Al+3]>[OH-].[Na+].O1CCOCC1>C(C1=CC=CC=C1)N1CCC2(CNC3=NC(=CC=C32)Cl)CC1 | 3 |
C(C)(=O)C1C(=O)OCC1.N1=C(NC2=C1C=CC=C2)CC#N>>OCCC1=C(C(=C2NC3=C(N2C1=O)C=CC=C3)C#N)C | 5 |
BrC1=CN=C2N1N=CC(=N2)C(C)(C)O.FC=1C(=NC=C(C1)F)C=1C=C(C=CC1)B(O)O>Cl>FC=1C(=NC=C(C1)F)C=1C=C(C=CC1)C1=CN=C2N1N=CC(=N2)C(C)(C)O | 3 |
C([O:8][C:9]1[CH:42]=[CH:41][C:12]([C:13]2[O:14][C:15]3[C:20]([C:21](=[O:40])[C:22]=2OC(CCCCC(OCC2C=CC=CC=2)=O)=O)=[CH:19][CH:18]=[CH:17][CH:16]=3)=[CH:11][CH:10]=1)C1C=CC=CC=1.[H][H]>C1COCC1.C(O)C.CC(O)=O.[OH-].[OH-].[Pd+2]>[OH:8][C:9]1[CH:10]=[CH:11][C:12]([C:13]2[O:14][C:15]3[C:20]([C:21](=[O:40])[CH:22]=2)=[CH:19][CH:18]=[CH:17][CH:16]=3)=[CH:41][CH:42]=1 | 1 |
S1C(=NC=C1)C1=CN=C(N=N1)N>>BrC1=CN=C(S1)C1=CN=C(N=N1)N | 5 |
C(C)(C)(C)OC(=O)N1CCC(CC1)(CCC(=O)OC)CCC(=O)OC>CC(C)(C)[O-].[K+].C1CCCO1>O=C1C(CC2(CCN(CC2)C(=O)OC(C)(C)C)CC1)C(=O)OC | 3 |
[Si](C)(C)(C(C)(C)C)OC[C@@H](C(OOC)CC1=CC=CC=C1)OCCOC1OCCCC1>C1CCCO1.[F-].C(CCC)[N+](CCCC)(CCCC)CCCC>COOC[C@@H](C(O)CC1=CC=CC=C1)OCCOC1OCCCC1 | 3 |
ClC=1C=C(C=CC1[N+](=O)[O-])N(S(=O)(=O)C)C1=CC2=C(C(=C(O2)C2=CC=C(C=C2)F)C(=O)NC)C=C1C1CC1>>NC1=C(C=C(C=C1)N(S(=O)(=O)C)C1=CC2=C(C(=C(O2)C2=CC=C(C=C2)F)C(=O)NC)C=C1C1CC1)Cl | 5 |
C(C1=CC=CC=C1)(=O)Cl.OC(C(=O)C1=CC=CC=C1)C>C([O-])([O-])=O.[K+].[K+].CC(=O)C>C(C1=CC=CC=C1)(=O)OC(C(=O)C1=CC=CC=C1)C | 3 |
[NH2:1][C:2]1[N:10]=[CH:9][CH:8]=[CH:7][C:3]=1[C:4]([OH:6])=O.ON1C2C=CC=CC=2N=N1.CCN=C=NCCCN(C)C.[CH3:32][C:33]1[CH:47]=[CH:46][C:36]([O:37][C:38]2[CH:45]=[CH:44][C:41]([CH2:42][NH2:43])=[CH:40][CH:39]=2)=[CH:35][CH:34]=1>O.CN(C=O)C>[CH3:32][C:33]1[CH:47]=[CH:46][C:36]([O:37][C:38]2[CH:45]=[CH:44][C:41]([CH2:42][NH:43][C:4](=[O:6])[C:3]3[CH:7]=[CH:8][CH:9]=[N:10][C:2]=3[NH2:1])=[CH:40][CH:39]=2)=[CH:35][CH:34]=1 | 2 |
[CH3:1][O:2][C:3]1[CH:4]=[CH:5][CH:6]=[CH:7][C:8]=1[O:9][CH2:10][CH:11]([OH:14])[CH2:12]O.N1C=CC=CC=1.[CH3:21][NH:22][S:23](Cl)(=[O:25])=[O:24].C(Cl)[Cl:28]>>[Cl:28][CH2:12][CH:11]([O:14][S:23](=[O:25])(=[O:24])[NH:22][CH3:21])[CH2:10][O:9][C:8]1[CH:7]=[CH:6][CH:5]=[CH:4][C:3]=1[O:2][CH3:1] | 1 |
ClC1=NC=C(C(=N1)NC)C(F)(F)F.NC1=C(N=C(S1)C(C#N)(C)C)C>O1CCOCC1.O.C1(=CC=C(C=C1)S(=O)(=O)O)C>CC(C#N)(C)C=1SC(=C(N1)C)NC1=NC=C(C(=N1)NC)C(F)(F)F | 3 |
[Br:1][C:2]1[C:3]([O:18][C:19]2[CH:24]=[CH:23][C:22]([C:25]([O:27][C:28]([CH3:31])([CH3:30])[CH3:29])=[O:26])=[CH:21][C:20]=2[N+:32]([O-])=O)=[C:4]([Cl:17])[CH:5]=[C:6]2[C:11]=1[O:10][CH2:9][CH2:8][CH:7]2[C:12]([O:14][CH2:15][CH3:16])=[O:13].[Cl-].[NH4+]>O1CCCC1.[Zn]>[NH2:32][C:20]1[CH:21]=[C:22]([C:25]([O:27][C:28]([CH3:29])([CH3:31])[CH3:30])=[O:26])[CH:23]=[CH:24][C:19]=1[O:18][C:3]1[C:2]([Br:1])=[C:11]2[C:6]([CH:7]([C:12]([O:14][CH2:15][CH3:16])=[O:13])[CH2:8][CH2:9][O:10]2)=[CH:5][C:4]=1[Cl:17] | 1 |
[F:1][C:2]1[CH:7]=[CH:6][C:5]([C:8]([C:30]2[CH:35]=[CH:34][C:33]([F:36])=[CH:32][CH:31]=2)=[CH:9][CH2:10][CH2:11][N:12]2[CH2:17][CH2:16][C:15]([C:28]#[CH:29])([O:18][C:19]([O:21]C3C=CC=CC=3)=O)[CH2:14][CH2:13]2)=[CH:4][CH:3]=1.[CH2:37]([NH2:44])[C:38]1[CH:43]=[CH:42][CH:41]=[CH:40][CH:39]=1>C1C=CC=CC=1>[CH2:37]([NH:44][C:19]([O:18][C:15]1([C:28]#[CH:29])[CH2:14][CH2:13][N:12]([CH2:11][CH2:10][CH:9]=[C:8]([C:30]2[CH:35]=[CH:34][C:33]([F:36])=[CH:32][CH:31]=2)[C:5]2[CH:4]=[CH:3][C:2]([F:1])=[CH:7][CH:6]=2)[CH2:17][CH2:16]1)=[O:21])[C:38]1[CH:43]=[CH:42][CH:41]=[CH:40][CH:39]=1 | 1 |
[N+](=O)([O-])C1=CC=C(C=C1)N1C(CCC1)C(=O)O>CO[H].ClS(Cl)=O>COC(=O)C1N(CCC1)C1=CC=C(C=C1)[N+](=O)[O-] | 3 |
ClC1=CC=C(C=C1)B(O)O.BrC=1C(=C(SC1C1=C(C=CC=C1)Cl)C(=O)OC)OC>C1(=CC=CC=C1)C.C([O-])([O-])=O.[Na+].[Na+]>ClC1=C(C=CC=C1)C1=C(C(=C(S1)C(=O)OC)OC)C1=CC=C(C=C1)Cl | 3 |
[F:1][C:2]1[CH:7]=[C:6]([NH2:8])[CH:5]=[CH:4][C:3]=1[N:9]([CH2:16][CH2:17][CH2:18][CH2:19][CH2:20][CH3:21])[CH2:10][CH2:11][CH2:12][CH2:13][CH2:14][CH3:15].C[Al](C)C.[NH:26](/[C:30](/[CH3:36])=[CH:31]\[C:32](OC)=[O:33])[C:27]([CH3:29])=O>C(Cl)Cl>[CH2:10]([N:9]([CH2:16][CH2:17][CH2:18][CH2:19][CH2:20][CH3:21])[C:3]1[CH:4]=[CH:5][C:6]([N:8]2[C:32](=[O:33])[CH:31]=[C:30]([CH3:36])[N:26]=[C:27]2[CH3:29])=[CH:7][C:2]=1[F:1])[CH2:11][CH2:12][CH2:13][CH2:14][CH3:15] | 1 |
ClC(Cl)(OC(OC(Cl)(Cl)Cl)=O)Cl.NC=1C(=C(C(=CC1)Cl)S(=O)(=O)N)O.ClC1=C(N)C=CC=C1F>>ClC1=C(C(=C(C=C1)NC(=O)NC1=C(C(=CC=C1)F)Cl)O)S(=O)(=O)N | 5 |
CC(C)C(=O)OC[C@@H]1[C@H]([C@@H]([C@](O1)(COC(=O)C)O[C@@H]2[C@@H]([C@H]([C@@H]([C@H](O2)COC(=O)C)OC(=O)C(C)C)OC(=O)C(C)C)OC(=O)C(C)C)OC(=O)C(C)C)OC(=O)C(C)C>CCO[H]>CC(C)C(=O)OC[C@@H]1[C@H]([C@@H]([C@](O1)(COC(=O)C)O[C@@H]2[C@@H]([C@H]([C@@H]([C@H](O2)COC(=O)C)OC(=O)C(C)C)OC(=O)C(C)C)OC(=O)C(C)C)OC(=O)C(C)C)OC(=O)C(C)C.[Si](=O)=O | 3 |
ClC=1C2=C(N=CN1)N(C=C2)C2CC2>N(C)(C)C=O.IN1C(CCC1=O)=O>ClC=1C2=C(N=CN1)N(C=C2I)C2CC2 | 3 |
ClC1=C(C(=CC=C1)OC)CC(=O)NC(C(=O)OC)(C(C)C)C>C1(=CC=CC=C1)C.CC(C)(C)[O-].[K+].C1CCCO1>ClC1=C(C(=CC=C1)OC)C1C(NC(C1=O)(C)C(C)C)=O | 3 |
C([O:6][CH:7]([C:9]1[CH:14]=[CH:13][C:12]([O:15][CH:16]([O:18][CH2:19][CH3:20])[CH3:17])=[CH:11][CH:10]=1)[CH3:8])(=O)CCC>C(O)C.[OH-].[K+]>[CH2:19]([O:18][CH:16]([O:15][C:12]1[CH:11]=[CH:10][C:9]([CH:7]([OH:6])[CH3:8])=[CH:14][CH:13]=1)[CH3:17])[CH3:20] | 1 |
[Cl:1][C:2]1[CH:3]=[C:4]([CH:7]=[CH:8][C:9]=1[Cl:10])[CH:5]=O.[NH2:11][C:12]1[CH:13]=[C:14]2[C:18]3=[C:19]([CH2:21][S:22][CH2:23][CH2:24][N:17]3[C@H:16]3[CH2:25][CH2:26][N:27](C(OC(C)(C)C)=O)[CH2:28][C@@H:15]23)[CH:20]=1>>[Cl:1][C:2]1[CH:3]=[C:4]([CH:7]=[CH:8][C:9]=1[Cl:10])[CH2:5][NH:11][C:12]1[CH:13]=[C:14]2[C:18]3=[C:19]([CH2:21][S:22][CH2:23][CH2:24][N:17]3[C@H:16]3[CH2:25][CH2:26][NH:27][CH2:28][C@@H:15]23)[CH:20]=1 | 1 |
C(C)(C)(C)OC(=O)N1C[C@H]2CC3=CC(=C(N=C3N2[C@@H](C1)C)CN(C1CC1)C(=O)OC(C)(C)C)Br>>C(C)(C)(C)OC(=O)N1C[C@H]2CC3=CC(=C(N=C3N2[C@@H](C1)C)CN(C1CC1)C(=O)OC(C)(C)C)C=O | 5 |
FC(CN)(F)F.C(C)(C)(C)OC(=O)NCC(=O)O>C(C)(=O)OCC.C(=O)(C=1NC=CN1)C=1NC=CN1>C(C)(C)(C)OC(NCC(NCC(F)(F)F)=O)=O | 3 |
N(=[N+]=[N-])[C@H]1COC[C@H]([C@@H]1O)S.C(C)(=O)OC[C@H]1O[C@@H]([C@@H]([C@H]([C@H]1OC(C)=O)N1N=NC(=C1)C1=CC(=CC=C1)F)OC)Br>C(C)(=O)OCC.C([O-])([O-])=O.[Na+].[Na+].C(O)([O-])=O.[Na+].S(=O)(=O)(O)[O-].C(CCC)[N+](CCCC)(CCCC)CCCC>C(C)(=O)OC[C@H]1O[C@H]([C@@H]([C@H]([C@H]1OC(C)=O)N1N=NC(=C1)C1=CC(=CC=C1)F)OC)S[C@@H]1COC[C@@H]([C@H]1O)N=[N+]=[N-] | 3 |
Cl[C:2]1[CH:27]=[CH:26][C:5]([C:6]([NH:8][C:9]2[S:10][C:11]3[C:17]([N:18]4[CH2:23][CH2:22][O:21][CH2:20][CH2:19]4)=[CH:16][CH:15]=[C:14]([O:24][CH3:25])[C:12]=3[N:13]=2)=[O:7])=[CH:4][N:3]=1.C(=O)([O-])[O-].[Cs+].[Cs+].[CH3:34][O:35][CH2:36][CH2:37][NH2:38]>>[CH3:34][O:35][CH2:36][CH2:37][NH:38][C:2]1[CH:27]=[CH:26][C:5]([C:6]([NH:8][C:9]2[S:10][C:11]3[C:17]([N:18]4[CH2:19][CH2:20][O:21][CH2:22][CH2:23]4)=[CH:16][CH:15]=[C:14]([O:24][CH3:25])[C:12]=3[N:13]=2)=[O:7])=[CH:4][N:3]=1 | 1 |
Br[C:2]1[CH:11]=[C:10]2[C:5]([CH2:6][CH:7]([CH3:26])[N:8]([C:12]3[CH:17]=[C:16]([N:18]4[CH2:23][CH2:22][N:21]([CH3:24])[CH2:20][CH2:19]4)[N:15]=[C:14]([NH2:25])[N:13]=3)[CH2:9]2)=[CH:4][CH:3]=1.CC1(C)C(C)(C)OB([C:35]2[CH2:36][CH2:37][N:38]([C:41]([O:43][C:44]([CH3:47])([CH3:46])[CH3:45])=[O:42])[CH2:39][CH:40]=2)O1.ClCCl.C(=O)([O-])[O-].[K+].[K+]>O1CCOCC1.O>[NH2:25][C:14]1[N:13]=[C:12]([N:8]2[CH:7]([CH3:26])[CH2:6][C:5]3[C:10](=[CH:11][C:2]([C:35]4[CH2:40][CH2:39][N:38]([C:41]([O:43][C:44]([CH3:47])([CH3:46])[CH3:45])=[O:42])[CH2:37][CH:36]=4)=[CH:3][CH:4]=3)[CH2:9]2)[CH:17]=[C:16]([N:18]2[CH2:23][CH2:22][N:21]([CH3:24])[CH2:20][CH2:19]2)[N:15]=1 | 1 |
[NH2:1][C:2]1[S:6][CH:5]=[C:4]([C:7]#[N:8])[C:3]=1[C:9]1[S:10][CH:11]=[CH:12][N:13]=1.[O:14]=[C:15]1[CH:24]=[CH:23][C:22]2[C:17](=[CH:18][CH:19]=[C:20]([C:25]([F:28])([F:27])[F:26])[CH:21]=2)[N:16]1[CH2:29][C:30](O)=[O:31]>>[C:7]([C:4]1[C:3]([C:9]2[S:10][CH:11]=[CH:12][N:13]=2)=[C:2]([NH:1][C:30](=[O:31])[CH2:29][N:16]2[C:17]3[C:22](=[CH:21][C:20]([C:25]([F:26])([F:28])[F:27])=[CH:19][CH:18]=3)[CH:23]=[CH:24][C:15]2=[O:14])[S:6][CH:5]=1)#[N:8] | 1 |
FC1=NC2=C(C=3C=CC=C(C13)F)N(N=N2)C.BrC1=NC=CC(=C1)NCC(F)F>C1CCCO1.C[Si](C)(C)[N-][Si](C)(C)C.[Li+].[Cl-].[NH4+]>BrC1=NC=CC(=C1)N(C1=NC2=C(C=3C=CC=C(C13)F)N(N=N2)C)CC(F)F | 3 |
C(=O)([O-])[O-].[Cs+].[Cs+].[OH:7][C:8]1[CH:13]=[CH:12][C:11]([C:14]2[CH:15]=[C:16]3[C:21](=[CH:22][CH:23]=2)[N:20]=[C:19]([C:24]([O:26][CH2:27][CH3:28])=[O:25])[CH:18]=[CH:17]3)=[CH:10][C:9]=1[CH3:29].Cl[CH2:31][C:32]1[C:33]([C:40]2[C:45]([Cl:46])=[CH:44][CH:43]=[CH:42][C:41]=2[Cl:47])=[N:34][O:35][C:36]=1[CH:37]([CH3:39])[CH3:38].O>CN(C)C=O>[Cl:46][C:45]1[CH:44]=[CH:43][CH:42]=[C:41]([Cl:47])[C:40]=1[C:33]1[C:32]([CH2:31][O:7][C:8]2[CH:13]=[CH:12][C:11]([C:14]3[CH:15]=[C:16]4[C:21](=[CH:22][CH:23]=3)[N:20]=[C:19]([C:24]([O:26][CH2:27][CH3:28])=[O:25])[CH:18]=[CH:17]4)=[CH:10][C:9]=2[CH3:29])=[C:36]([CH:37]([CH3:39])[CH3:38])[O:35][N:34]=1 | 1 |
Cl.[CH3:2][NH:3][OH:4].N1C=CC=CC=1.[C:11]([C:19]1[CH:27]=[CH:26][CH:25]=[CH:24][C:20]=1[C:21](Cl)=[O:22])(=[O:18])[C:12]1[CH:17]=[CH:16][CH:15]=[CH:14][CH:13]=1>ClCCl>[CH3:2][N:3]([C:21](=[O:22])[C:20]1[CH:24]=[CH:25][CH:26]=[CH:27][C:19]=1[C:11](=[O:18])[C:12]1[CH:13]=[CH:14][CH:15]=[CH:16][CH:17]=1)[OH:4] | 2 |
[CH3:1][C:2]1[C:12]2[S:11][CH2:10][CH2:9][CH2:8][NH:7][C:6]=2[CH:5]=[CH:4][CH:3]=1.CC(O)=O.[N:17]([O-])=[O:18].[Na+]>O>[CH3:1][C:2]1[C:12]2[S:11][CH2:10][CH2:9][CH2:8][N:7]([N:17]=[O:18])[C:6]=2[CH:5]=[CH:4][CH:3]=1 | 1 |
C1(=CC=CC=C1)C1=CC=2NN=CC2S1>>IC=1C2=C(NN1)C=C(S2)C2=CC=CC=C2 | 5 |
CC(C#C)(C)OC1=C(C=O)C=CC=C1>CCN(CC)C=1C=CC=CC1>CC1(OC2=C(C=CC=C2C=C1)C=O)C | 3 |
[C:1]([O:5][C:6]([N:8]([C:28]([O:30][C:31]([CH3:34])([CH3:33])[CH3:32])=[O:29])[C@@H:9]([C:25]([O-:27])=[O:26])[CH2:10][CH2:11][C@@H:12]([C:17]1[CH:22]=[CH:21][CH:20]=[C:19]([F:23])[C:18]=1[F:24])[CH2:13][N+:14]([O-:16])=[O:15])=[O:7])([CH3:4])([CH3:3])[CH3:2].CN(C)C(N(C)C)=N.[CH2:43]=[O:44]>C(#N)C.C([O-])(O)=O.[Na+]>[C:31]([O:30][C:28]([N:8]([C:6]([O:5][C:1]([CH3:4])([CH3:3])[CH3:2])=[O:7])[C@H:9]([CH2:10][CH2:11][C@@H:12]([C:17]1[CH:22]=[CH:21][CH:20]=[C:19]([F:23])[C:18]=1[F:24])[CH:13]([N+:14]([O-:16])=[O:15])[CH2:43][OH:44])[C:25]([O:27][CH2:12][C:17]1[CH:22]=[CH:21][CH:20]=[CH:19][CH:18]=1)=[O:26])=[O:29])([CH3:34])([CH3:33])[CH3:32] | 1 |
C(C)OC(\C=C\C=C(C1=CC=CC=C1)C1=CC=CC=C1)=O>CO[H].[OH-].[K+]>C1(=CC=CC=C1)C(=C/C=C/C(=O)O)C1=CC=CC=C1 | 3 |
S(=O)(=O)(OC)OC.C[C@]12CC[C@H](C=3C(N(NC13)C1=CC=C(C=C1)C)=O)C2(C)C>>CN1N(C(C=2[C@H]3CC[C@@](C12)(C3(C)C)C)=O)C3=CC=C(C=C3)C.COC=1N(N=C2[C@@]3(CC[C@H](C12)C3(C)C)C)C3=CC=C(C=C3)C | 5 |
[N+:1]([C:4]1[CH:5]=[C:6]([CH2:10]Br)[CH:7]=[CH:8][CH:9]=1)([O-:3])=[O:2].Cl.[CH3:13][NH:14][CH3:15].C(N(CC)CC)C>CN(C)C=O>[N+:1]([C:4]1[CH:5]=[C:6]([CH2:10][N:14]([CH3:15])[CH3:13])[CH:7]=[CH:8][CH:9]=1)([O-:3])=[O:2] | 1 |
FC1=CC=C(C=C1)C1=C(C(=NC=2C(CN(CC12)C(=O)OCC[Si](C)(C)C)(C)C)C(C)C)CO>>FC1=CC=C(C=C1)C1=C(C(=NC=2C(CN(CC12)C(=O)OCC[Si](C)(C)C)(C)C)C(C)C)C=O | 5 |
[C:1]([C:3]1[C:12]2[C:7](=[CH:8][CH:9]=[C:10]([O:13][C:14]3[CH:19]=[CH:18][CH:17]=[CH:16][CH:15]=3)[CH:11]=2)[C:6]([OH:20])=[C:5]([C:21](OC)=[O:22])[N:4]=1)#[N:2].[NH2:25][CH2:26][CH2:27][C@H:28]([OH:32])[C:29]([OH:31])=[O:30].C[O-].[Na+]>COCCO>[C:1]([C:3]1[C:12]2[C:7](=[CH:8][CH:9]=[C:10]([O:13][C:14]3[CH:15]=[CH:16][CH:17]=[CH:18][CH:19]=3)[CH:11]=2)[C:6]([OH:20])=[C:5]([C:21]([NH:25][CH2:26][CH2:27][C@H:28]([OH:32])[C:29]([OH:31])=[O:30])=[O:22])[N:4]=1)#[N:2] | 1 |
ClC1=CC(=C(C=C1Cl)[C@@H](C1CCN(CC1)C([C@H](CNC(OC(C)(C)C)=O)O)=O)N[S@@](=O)C(C)(C)C)OCC=C>>NC[C@@H](C(=O)N1CCC(CC1)[C@@H](N[S@@](=O)C(C)(C)C)C1=C(C=C(C(=C1)Cl)Cl)OCC=C)O | 5 |
[NH:1]1[CH2:4][CH:3]([N:5]2[CH:9]=[C:8]([C:10]3[CH:11]=[C:12]4[C:18]([CH:19]([C:21]5[C:26]([Cl:27])=[CH:25][CH:24]=[C:23]([F:28])[C:22]=5[Cl:29])[CH3:20])=[CH:17][NH:16][C:13]4=[N:14][CH:15]=3)[CH:7]=[N:6]2)[CH2:2]1.C(O)=O.[CH3:33][N:34]([C:36]([O:40]N1N=NC2C=CC=CC1=2)=[N+](C)C)[CH3:35].[B-](F)(F)(F)F.CCN(C(C)C)C(C)C>CN(C=O)C>[CH3:33][N:34]([CH3:35])[C:36]([N:1]1[CH2:2][CH:3]([N:5]2[CH:9]=[C:8]([C:10]3[CH:11]=[C:12]4[C:18]([CH:19]([C:21]5[C:26]([Cl:27])=[CH:25][CH:24]=[C:23]([F:28])[C:22]=5[Cl:29])[CH3:20])=[CH:17][NH:16][C:13]4=[N:14][CH:15]=3)[CH:7]=[N:6]2)[CH2:4]1)=[O:40] | 1 |
OCC=1C=CC(=NC1)C(=O)N1CCN(CC1)C(C)C>ClCCl.[O-2].[Mn+2]>C(C)(C)N1CCN(CC1)C(=O)C1=CC=C(C=N1)C=O | 3 |
C(C)(C)(C)OC(=O)N[C@@H](CCC(N(C)C)=O)C(=O)OC>Cl.O1CCOCC1>Cl.CN(C(CC[C@H](N)C(=O)OC)=O)CCC1=CC=CC=C1 | 3 |
[CH:1]1([CH2:6][CH:7]([N:11]2[C:16](=[O:17])[CH:15]=[C:14]([O:18][C:19]3[CH:24]=[CH:23][CH:22]=[CH:21][C:20]=3[S:25]([CH3:28])(=[O:27])=[O:26])[CH:13]=[N:12]2)[C:8]([OH:10])=O)[CH2:5][CH2:4][CH2:3][CH2:2]1.[NH2:29][C:30]1[CH:34]=[CH:33][N:32]([CH2:35][C:36]([CH3:39])([OH:38])[CH3:37])[N:31]=1>>[CH:1]1([CH2:6][CH:7]([N:11]2[C:16](=[O:17])[CH:15]=[C:14]([O:18][C:19]3[CH:24]=[CH:23][CH:22]=[CH:21][C:20]=3[S:25]([CH3:28])(=[O:27])=[O:26])[CH:13]=[N:12]2)[C:8]([NH:29][C:30]2[CH:34]=[CH:33][N:32]([CH2:35][C:36]([OH:38])([CH3:37])[CH3:39])[N:31]=2)=[O:10])[CH2:2][CH2:3][CH2:4][CH2:5]1 | 1 |
[CH3:1][O:2][C:3](=[O:25])[C:4]1[CH:9]=[C:8]([N+:10]([O-])=O)[C:7]([NH:13][CH3:14])=[CH:6][C:5]=1[N:15]1[CH2:20][CH2:19][CH:18]([C:21]([F:24])([F:23])[F:22])[CH2:17][CH2:16]1>[Ni].CO>[CH3:1][O:2][C:3](=[O:25])[C:4]1[CH:9]=[C:8]([NH2:10])[C:7]([NH:13][CH3:14])=[CH:6][C:5]=1[N:15]1[CH2:16][CH2:17][CH:18]([C:21]([F:22])([F:24])[F:23])[CH2:19][CH2:20]1 | 1 |
C1COC2(CCC(CC2)=O)O1>>FC1=CCC2(OCCO2)CC1 | 5 |
C(OC([NH:11][C@H:12]([C:16]([NH2:18])=[O:17])[C@@H:13]([CH3:15])O)=O)C1C=CC=CC=1.C[S:20](Cl)(=[O:22])=[O:21].[OH2:24]>N1C=CC=CC=1>[NH2:11][C@H:12]1[C@H:13]([CH3:15])[N:18]([S:20]([OH:22])(=[O:24])=[O:21])[C:16]1=[O:17] | 1 |
[F:1][C:2]1[C:3]([C:22]([OH:24])=O)=[N:4][CH:5]=[CH:6][C:7]=1[S:8][C:9]1[S:13][C:12]([NH:14][C:15]2[CH:20]=[C:19]([CH3:21])[CH:18]=[CH:17][N:16]=2)=[N:11][CH:10]=1.[NH2:25][CH2:26][C:27]1([C:40]2[CH:45]=[CH:44][C:43]([Cl:46])=[C:42]([Cl:47])[CH:41]=2)[CH2:32][CH2:31][N:30]([C:33]([O:35][C:36]([CH3:39])([CH3:38])[CH3:37])=[O:34])[CH2:29][CH2:28]1>>[Cl:47][C:42]1[CH:41]=[C:40]([C:27]2([CH2:26][NH:25][C:22](=[O:24])[C:3]3[C:2]([F:1])=[C:7]([S:8][C:9]4[S:13][C:12]([NH:14][C:15]5[CH:20]=[C:19]([CH3:21])[CH:18]=[CH:17][N:16]=5)=[N:11][CH:10]=4)[CH:6]=[CH:5][N:4]=3)[CH2:28][CH2:29][N:30]([C:33]([O:35][C:36]([CH3:37])([CH3:38])[CH3:39])=[O:34])[CH2:31][CH2:32]2)[CH:45]=[CH:44][C:43]=1[Cl:46] | 1 |
COC=1C=C2C(C=C(OC2=C(C1)N1CCN(CC1)CC(F)(F)F)C(=O)O)=O.Cl.[Li+].[Cl-]>[HH].[Pd].C(C)(=O)O>COC=1C=C2CCC(OC2=C(C1)N1CCN(CC1)CC(F)(F)F)C(=O)O | 3 |
NC1=C(C#N)C=C(C(=N1)C(F)(F)F)Cl>S(O)(O)(=O)=O.C(O)([O-])=O.[Na+]>NC1=C(C(=O)N)C=C(C(=N1)C(F)(F)F)Cl | 3 |
[H-].[Al+3].[Li+].[H-].[H-].[H-].[S:7]1[C:12]2[CH:13]=[CH:14][CH:15]=[CH:16][C:11]=2[NH:10][C:9](=O)[CH2:8]1.O.[OH-].[Na+]>O1CCCC1>[S:7]1[C:12]2[CH:13]=[CH:14][CH:15]=[CH:16][C:11]=2[NH:10][CH2:9][CH2:8]1 | 2 |
COC(CCN)=O.C1(=CC=CC=C1)C1=NOC(=C1)C(=O)O>ClCCl.C(C)(=O)OCC.C(C)(C)N(C(C)C)CC.CCCP1(=O)OP(=O)(OP(=O)(O1)CCC)CCC>C1(=CC=CC=C1)C1=NOC(=C1)C(=O)NCCC(=O)OC | 3 |
[OH:1][C:2]1[CH:11]=[CH:10][CH:9]=[CH:8][C:3]=1[O:4][CH2:5][CH2:6][OH:7].[N+:12]([O-:15])([OH:14])=O.[N+:16]([O-])([OH:18])=[O:17]>N([O-])=O.[Na+]>[OH:1][C:2]1[C:11]([N+:12]([O-:15])=[O:14])=[CH:10][C:9]([N+:16]([O-:18])=[O:17])=[CH:8][C:3]=1[O:4][CH2:5][CH2:6][OH:7] | 1 |
C(C)(C)(C)OC(=O)N1CC(CC1)C(NC=1C=C2C(=NN(C2=CC1C=O)C(C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1)Br)=O>>C(C)(C)(C)OC(=O)N1CC(CC1)C1=NC=2C=C3C(=CC2C=N1)N(N=C3Br)C(C3=CC=CC=C3)(C3=CC=CC=C3)C3=CC=CC=C3 | 5 |
[Na].[Br-].[N+](C1C=CC(C[N+:11]2[CH:32]=[CH:31][C:14]3=[C:15]([C:27]([O:29][CH3:30])=[O:28])[C:16]4[NH:17][C:18]5[CH:19]=[CH:20][CH:21]=[CH:22][C:23]=5[C:24]=4[C:25]([CH3:26])=[C:13]3[CH:12]=2)=CC=1)([O-])=O.N(C1C=CC(N(C)C)=CC=1)=O.C(Cl)(Cl)Cl>CO>[C:27]([C:15]1[C:16]2[NH:17][C:18]3[CH:19]=[CH:20][CH:21]=[CH:22][C:23]=3[C:24]=2[C:25]([CH3:26])=[C:13]2[CH:12]=[N:11][CH:32]=[CH:31][C:14]=12)([O:29][CH3:30])=[O:28] | 1 |
C(#N)C1=C(C=CC=C1)S(=O)(=O)Cl.CNCCCNC>>C(#N)C1=C(C=CC=C1)S(=O)(=O)N(CCCNC)C | 5 |
NC=1C=CC2=C(OC(CO2)CO)C1CS(=O)(=O)C1=CC=CC2=CC=CC=C12>C1CCCO1.Cl.N(=O)[O-].[Na+]>C1(=CC=CC2=CC=CC=C12)S(=O)(=O)C1=NNC2=CC=C3C(=C12)O[C@H](CO3)CO | 3 |
N(=O)C=CC=1SC=CC1>[Na+].[BH4-].CCO[H].O1CCOCC1>N(=O)CCC=1SC=CC1 | 3 |
CC(C)(C)OC(=O)NC1CCN(CC1)CC(C(=O)OC)C=1C(=CC=C2C=CC(=NC12)OC)F>O.C1CCCO1.[OH-].[Na+].[H-].[Al+3].[Li+].[H-].[H-].[H-]>FC1=CC=C2C=CC(=NC2=C1C(CN1CCC(CC1)NC(OC(C)(C)C)=O)CO)OC | 3 |
[CH:1]([CH:3]=O)=[O:2].[CH2:5]([NH:12][N:13]=[CH:14][C:15](=[O:17])[CH3:16])[C:6]1[CH:11]=[CH:10][CH:9]=[CH:8][CH:7]=1>O.CO>[CH2:5]([N:12]1[CH:16]=[C:15]([OH:17])[C:14]([C:1](=[O:2])[CH3:3])=[N:13]1)[C:6]1[CH:11]=[CH:10][CH:9]=[CH:8][CH:7]=1 | 1 |
[Cl-:1].[NH4+:2].C[Al](C)C.[CH3:7][C@@H:8]([CH2:12][CH3:13])[CH2:9][C:10]#[N:11].CO>C1(C)C=CC=CC=1>[ClH:1].[CH3:7][C@@H:8]([CH2:12][CH3:13])[CH2:9][C:10]([NH2:2])=[NH:11] | 1 |
[O:1]1[C:5]2([CH2:10][CH2:9][CH:8]([OH:11])[CH2:7][CH2:6]2)[O:4][CH2:3][CH2:2]1.[S:12](Cl)([C:15]1[CH:21]=[CH:20][C:18]([CH3:19])=[CH:17][CH:16]=1)(=[O:14])=[O:13].O>N1C=CC=CC=1>[CH3:19][C:18]1[CH:20]=[CH:21][C:15]([S:12]([O:11][CH:8]2[CH2:9][CH2:10][C:5]3([O:4][CH2:3][CH2:2][O:1]3)[CH2:6][CH2:7]2)(=[O:14])=[O:13])=[CH:16][CH:17]=1 | 1 |
COC(=O)C=1C=CC=2C(C3=CC=CC=C3OC2C1)=O>CCO[H].[OH-].[Na+]>O=C1C2=CC=CC=C2OC=2C=C(C=CC12)C(=O)O | 3 |
C(C1=CC=CC=C1)ON[C@@H]1CC[C@H](NC1)C(=O)OC(C)(C)C>CC#N.C1(=CC=NC=C1)N(C)C.CCN(CC)CC.ClC(=O)OC(Cl)(Cl)Cl>C(C1=CC=CC=C1)ON1[C@@H]2CC[C@H](N(C1=O)C2)C(=O)OC(C)(C)C | 3 |
[NH:1]([C:3]1[N:4]=[N:5][C:6]([N:10]2[CH2:15][CH2:14][O:13][CH2:12][CH2:11]2)=[CH:7][C:8]=1[CH3:9])[NH2:2].[CH:16](O)=O>>[CH3:9][C:8]1[C:3]2[N:4]([CH:16]=[N:2][N:1]=2)[N:5]=[C:6]([N:10]2[CH2:11][CH2:12][O:13][CH2:14][CH2:15]2)[CH:7]=1 | 1 |
[Si](C)(C)(C(C)(C)C)OC[C@@H](C)N(S(=O)(=O)C1=CC=C(C=C1)[N+](=O)[O-])CC1=C(C=CC=C1)NC(C1=C(C=C(C=C1)N1CCCC1)Cl)=O>>ClC1=C(C(=O)NC2=C(C=CC=C2)CN(S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-])[C@@H](CO)C)C=CC(=C1)N1CCCC1 | 5 |
BrC1=C(C=CC=C1)B(O)O.BrC=1N=C(C(=NC1)N(C(OC(C)(C)C)=O)C(=O)OC(C)(C)C)C=1OC(=NN1)C1=CC=CC=C1>>C(C)(C)(C)OC(N(C(=O)OC(C)(C)C)C1=NC=C(N=C1C=1OC(=NN1)C1=CC=CC=C1)C1=C(C=CC=C1)Br)=O | 5 |
ClS(=O)(=O)N=C=O.CC1(OB(OC1(C)C)C1=CC=C(N)C=C1)C>>NC(=O)NC1=CC=C(C=C1)B(O)O | 5 |
C1(CCCCC1)C(=O)Cl.NC1=NC2=CC=C(C=C2C=N1)OC1=CC(=NC=C1)C(=O)NC>>C1(CCCCC1)C(=O)NC1=NC2=CC=C(C=C2C=N1)OC1=CC(=NC=C1)C(=O)NC | 5 |
C(#N)C=1C=C(C=CC1F)C1=NC(=NO1)C1=C2C=CN=C(C2=CC=C1)CCC(=O)OC(C)(C)C.FC1CNCC1>N(C)(C)C=O.[H-].[Na+]>C(#N)C=1C=C(C=CC1N1CC(CC1)F)C1=NC(=NO1)C1=C2C=CN=C(C2=CC=C1)CCC(=O)OC(C)(C)C | 3 |
BrC1=CC(=CC=2NC(C(OC21)C(C)C)=O)CO>>BrC1=CC(=CC=2NC(C(OC21)C(C)C)=O)COC | 5 |
[S-]C#N.[K+].BrC1=C(C=C(N)C=C1)F>BrBr.C(C)(=O)O>BrC1=CC2=C(N=C(S2)N)C=C1F | 3 |
Cl.C1(=CC=CC=C1)N(N)C1=CC=CC=C1.ClC1=C(C=CC=C1)Br>>C1(=CC=CC=C1)N(NC1=C(C=CC=C1)Cl)C1=CC=CC=C1 | 5 |
[CH3:1][C:2]1[CH:7]=[CH:6][CH:5]=[C:4]([CH3:8])[C:3]=1[NH:9][C:10]([CH2:12][N:13]1[CH2:18][CH2:17][N:16](C(OCC2C=CC=CC=2)=O)[CH2:15][C:14]1=[O:29])=[O:11].[H][H]>CO>[CH3:8][C:4]1[CH:5]=[CH:6][CH:7]=[C:2]([CH3:1])[C:3]=1[NH:9][C:10](=[O:11])[CH2:12][N:13]1[CH2:18][CH2:17][NH:16][CH2:15][C:14]1=[O:29] | 1 |
Cl.[Cl-].[CH:3]([NH2+:6][CH2:7][CH2:8][CH2:9][CH2:10][CH:11]([C:24]([NH2:26])=[O:25])[C:12]1[CH:17]=[CH:16][CH:15]=[CH:14][C:13]=1[C:18]1[CH:23]=[CH:22][CH:21]=[CH:20][CH:19]=1)([CH3:5])[CH3:4]>C(OCC)C>[CH:3]([NH:6][CH2:7][CH2:8][CH2:9][CH2:10][CH:11]([C:24]([NH2:26])=[O:25])[C:12]1[CH:17]=[CH:16][CH:15]=[CH:14][C:13]=1[C:18]1[CH:23]=[CH:22][CH:21]=[CH:20][CH:19]=1)([CH3:5])[CH3:4] | 1 |
[CH2:1]([O:4][C:5]1[CH:13]=[CH:12][C:8]([C:9](Cl)=[O:10])=[CH:7][CH:6]=1)[CH:2]=[CH2:3].[C:14]([O:19][C:20]1[CH:29]=[CH:28][C:27]2[C:22](=[CH:23][C:24]([OH:30])=[CH:25][CH:26]=2)[CH:21]=1)(=[O:18])[C:15]([CH3:17])=[CH2:16].C(O)(=O)C(C)=C.C1(C=CC(O)=CC=1)O>C(N(CC)CC)C>[CH2:1]([O:4][C:5]1[CH:13]=[CH:12][C:8]([C:9]([O:30][C:24]2[CH:25]=[CH:26][C:27]3[C:22](=[CH:21][C:20]([O:19][C:14](=[O:18])[C:15]([CH3:17])=[CH2:16])=[CH:29][CH:28]=3)[CH:23]=2)=[O:10])=[CH:7][CH:6]=1)[CH:2]=[CH2:3] | 1 |
CI.COC(=O)C1=CC=C(C=C1)N1C=NC=C1>C1CCCO1.CO[H]>[I-].COC(=O)C1=CC=C(C=C1)[N+]1=CN(C=C1)C | 3 |
C1(=CC=CC=C1)S(=O)(=O)Cl.NC=1C=C(C=CC1)C1=NC(NC2=C3C(=CC=C12)C=CC=C3)=O>>O=C1NC2=C3C(=CC=C2C(=N1)C=1C=C(C=CC1)NS(=O)(=O)C1=CC=CC=C1)C=CC=C3 | 5 |
C(C)(C)(C)[Si](C)(C)Cl.BrC=1C=C(C=CC1OC)CO>>BrC=1C=C(CO[Si](C)(C)C(C)(C)C)C=CC1OC | 5 |
C(O)(C(F)(F)F)=O.C(OC([N:15]1[CH2:20][C@@H:19]2[CH2:21][C@H:16]1[CH2:17][N:18]2[S:22]([CH3:25])(=[O:24])=[O:23])=O)(C)(C)C>C(Cl)Cl>[CH3:25][S:22]([N:18]1[CH2:17][C@@H:16]2[CH2:21][C@H:19]1[CH2:20][NH:15]2)(=[O:23])=[O:24] | 1 |
Cl.Cl[C:3]1[CH:8]=[CH:7][NH:6][C:5](=[O:9])[C:4]=1[C:10]1[NH:21][C:20]2[CH:19]=[C:18]3[C:14]([CH:15]=[N:16][NH:17]3)=[CH:13][C:12]=2[N:11]=1.Cl.[NH2:23][CH2:24][C@H:25]([C:27]1[CH:32]=[CH:31][CH:30]=[C:29]([Br:33])[CH:28]=1)[OH:26].CN1CCOCC1>C(#N)C>[Br:33][C:29]1[CH:28]=[C:27]([C@H:25]([OH:26])[CH2:24][NH:23][C:3]2[CH:8]=[CH:7][NH:6][C:5](=[O:9])[C:4]=2[C:10]2[NH:21][C:20]3[CH:19]=[C:18]4[C:14]([CH:15]=[N:16][NH:17]4)=[CH:13][C:12]=3[N:11]=2)[CH:32]=[CH:31][CH:30]=1 | 1 |
BrC=1C(=C(C=C(C1)Cl)B1OC(C(O1)(C)C)(C)C)F>O(O[H])[H].O.C1CCCO1.[OH-].[Na+].[O-]S(=O)[O-].[Na+].[Na+]>BrC=1C(=C(C=C(C1)Cl)O)F | 3 |
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