smiles stringlengths 15 6.12k | source_id int64 1 5 |
|---|---|
C(=O)(O)C1=CC=C(C=O)C=C1>>C(=O)(O)C1=CC=C(C=C1)C(S(=O)(=O)[O-])O.[Na+] | 5 |
C(C)(=O)O[C@H]1[C@@H](O[C@@H]([C@H]1OC(C)=O)C#C)N1C2=NC=NC(=C2N=C1)Cl.Cl.CO[C@@H]1CC[C@H](CC1)N>C(C)(C)O.C(C)(C)N(C(C)C)CC>C(C)(=O)O[C@H]1[C@@H](O[C@@H]([C@H]1OC(C)=O)C#C)N1C2=NC=NC(=C2N=C1)N[C@@H]1CC[C@H](CC1)OC | 3 |
[Cl:1][C:2]1[CH:25]=[CH:24][C:5]([C:6]([N:8]2[C:16]3[C:11](=[CH:12][C:13]([O:17][CH3:18])=[CH:14][CH:15]=3)[C:10]([CH2:19][C:20]([OH:22])=[O:21])=[C:9]2[CH3:23])=[O:7])=[CH:4][CH:3]=1.[H-].[Na+].Cl[CH2:29][O:30][CH2:31][CH3:32].Cl>O1CCCC1>[CH2:31]([O:30][CH2:29][O:21][C:20](=[O:22])[CH2:19][C:10]1[C:11]2[C:16](=[CH:15][CH:14]=[C:13]([O:17][CH3:18])[CH:12]=2)[N:8]([C:6](=[O:7])[C:5]2[CH:24]=[CH:25][C:2]([Cl:1])=[CH:3][CH:4]=2)[C:9]=1[CH3:23])[CH3:32] | 1 |
O1CCCC=C1.C1(CCCCC1)[C@@H](CC[C@H]1[C@@H](C[C@@H]2OC(C[C@@H]21)=O)O)O>ClCCl.C1(=CC=C(C=C1)S(=O)(=O)O)C>C1(CCCCC1)[C@@H](CC[C@H]1[C@@H](C[C@@H]2OC(C[C@@H]21)=O)OC2OCCCC2)OC2OCCCC2 | 3 |
ClC1=CC=C(C=C1)B(O)O.BrC1=C(C=NN1C(C)(C)C)C=1SC=C(N1)CC(=O)NCC1CCOCC1>O.C([O-])([O-])=O.[K+].[K+].COCCOC.Cl[Pd]Cl.C(C)(C)(C)P(C1=CC=C(N(C)C)C=C1)C(C)(C)C>C(C)(C)(C)N1N=CC(=C1C1=CC=C(C=C1)Cl)C=1SC=C(N1)CC(=O)NCC1CCOCC1 | 3 |
[NH2:1][C:2]1[N:6]([C:7]2[CH:8]=[C:9]3[C:13](=[CH:14][C:15]=2[Cl:16])[C:12]([F:18])([F:17])[O:11][C:10]3([F:20])[F:19])[N:5]=[C:4]([C:21]#[N:22])[CH:3]=1.[F:23][C:24]([F:29])([F:28])[S:25]([O-])=[O:26].[Na+].S(C1C=CC(C)=CC=1)(O)(=O)=O.CNC.S(Cl)(Cl)=O>C1(C)C=CC=CC=1.O>[NH2:1][C:2]1[N:6]([C:7]2[CH:8]=[C:9]3[C:13](=[CH:14][C:15]=2[Cl:16])[C:12]([F:18])([F:17])[O:11][C:10]3([F:20])[F:19])[N:5]=[C:4]([C:21]#[N:22])[C:3]=1[S:25]([C:24]([F:29])([F:28])[F:23])=[O:26] | 1 |
Br[Zn]CC(=O)OCC.BrC1=CC=C(C=C1)C1(COC1)N(S(=O)C(C)(C)C)COCC[Si](C)(C)C>C1CCCO1.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].[Cl-].[NH4+].P(c2ccccc2c1c(cc(cc1C(C)C)C(C)C)C(C)C)(C3CCCCC3)C4CCCCC4>C(C)(C)(C)S(=O)N(C1(COC1)C1=CC=C(C=C1)CC(=O)OCC)COCC[Si](C)(C)C | 3 |
C1COCCN1.C(C)OC(=O)C=1N=C(SC1)Br>N(C)(C)C=O>N1(CCOCC1)C=1SC=C(N1)C(=O)OCC | 3 |
NC1=C(C(N=CN1)=O)C>C1CCCO1.CO[H].c3c(P(c1ccccc1)c2ccccc2)cccc3.N(=NC(=O)OC(C)C)C(=O)OC(C)C>CC=1C(=NC=NC1OC)N | 3 |
CN1C(=CC(=C1)NC(=O)OC(C)(C)C)C(=O)O.COC(=O)C1=CC2=C(S1)C=CC(=C2)N>N(C)(C)C=O.C1(=CC=NC=C1)N(C)C.Cl.CN(CCCN=C=NCC)C.C(O)([O-])=O.[Na+]>C(C)(C)(C)OC(=O)NC=1C=C(N(C1)C)C(=O)NC1=CC2=C(SC(=C2)C(=O)OC)C=C1 | 3 |
NC=1C=C(C=CC1)C(F)(F)F.CC=1SC2=C(N1)C=C(C=C2)C(=O)O>N(C)(C)C=O.C1(=CC=NC=C1)N(C)C.ClCCl.CCN=C=NCCCN(C)C>CC=1SC2=C(N1)C=C(C=C2)C(=O)NC2=CC(=CC=C2)C(F)(F)F | 3 |
CC=1C=C(C=CC1C)B(O)O.ClC=1C2=C(N=CN1)N(C=C2)S(=O)(=O)C2=CC=C(C=C2)C>>CC=1C=C(C=CC1C)C=1C2=C(N=CN1)NC=C2 | 5 |
BrC1=CC(=CC=C1)Cl>>ClC=1C=C(C=CC1)N1CCN(CC1)C(=O)OC(C)(C)C | 5 |
[NH2:1][C:2]1[CH:10]=[CH:9][C:5]([C:6]([NH2:8])=[O:7])=[C:4]([Cl:11])[CH:3]=1.[CH2:12]([N:14]1[C:23]2[C:18](=[N:19][C:20]([NH:24][C:25]([CH2:27][CH:28]([CH3:33])CC(O)=O)=[O:26])=[CH:21][N:22]=2)[C:17](=[O:34])[N:16]([CH2:35][CH3:36])[C:15]1=[O:37])[CH3:13].CCN([CH:44]([CH3:46])C)C(C)C.[CH2:47](P1(=O)OP(CCC)(=O)OP(CCC)(=O)O1)CC.[C:65](OCC)(=[O:67])C>CN(C=O)C>[CH2:12]([N:14]1[C:23]2[C:18](=[N:19][C:20]([NH:24][C:25]([CH:27]([C:65]([NH:1][C:2]3[CH:10]=[CH:9][C:5]([C:6](=[O:7])[NH2:8])=[C:4]([Cl:11])[CH:3]=3)=[O:67])[CH2:28][CH:33]([CH3:47])[CH2:44][CH3:46])=[O:26])=[CH:21][N:22]=2)[C:17](=[O:34])[N:16]([CH2:35][CH3:36])[C:15]1=[O:37])[CH3:13] | 2 |
[OH:1][CH:2]([CH2:20][CH2:21][CH2:22][CH2:23][CH3:24])[CH2:3][CH2:4][CH2:5][N:6]([CH2:11][CH2:12][CH2:13][CH2:14][CH2:15][CH2:16][C:17]([OH:19])=[O:18])[S:7]([CH3:10])(=[O:9])=[O:8].[C:25](OC(=O)C)(=[O:27])[CH3:26]>C(OCC)C>[C:25]([O:1][CH:2]([CH2:20][CH2:21][CH2:22][CH2:23][CH3:24])[CH2:3][CH2:4][CH2:5][N:6]([CH2:11][CH2:12][CH2:13][CH2:14][CH2:15][CH2:16][C:17]([OH:19])=[O:18])[S:7]([CH3:10])(=[O:8])=[O:9])(=[O:27])[CH3:26] | 1 |
[CH3:1][O:2][C:3]1[C:8]([NH:9][C:10](=[O:18])OC2C=CC=CC=2)=[CH:7][C:6]([CH2:19][CH2:20][CH3:21])=[C:5]([CH3:22])[N:4]=1.[F:23][C:24]1[CH:25]=[C:26]([N:31]2[CH2:36][CH2:35][NH:34][CH2:33][CH2:32]2)[CH:27]=[C:28]([F:30])[CH:29]=1>>[CH3:1][O:2][C:3]1[C:8]([NH:9][C:10]([N:34]2[CH2:33][CH2:32][N:31]([C:26]3[CH:25]=[C:24]([F:23])[CH:29]=[C:28]([F:30])[CH:27]=3)[CH2:36][CH2:35]2)=[O:18])=[CH:7][C:6]([CH2:19][CH2:20][CH3:21])=[C:5]([CH3:22])[N:4]=1 | 1 |
[NH:1]1[C:5]2[CH:6]=[CH:7][C:8]([N:10]([CH:19]([C:33]3[CH:38]=[CH:37][C:36]([N:39]4[CH2:44][CH2:43][O:42][CH2:41][CH2:40]4)=[CH:35][CH:34]=3)[C:20](=[O:32])NCC(OC(OC)=O)(CC)C)[C:11]([CH2:13][C:14]([O:16][CH2:17][CH3:18])=[O:15])=[O:12])=[CH:9][C:4]=2[N:3]=[CH:2]1.CC(C)([O-])C.[K+]>>[NH:1]1[C:5]2[CH:6]=[CH:7][C:8]([N:10]3[CH:19]([C:33]4[CH:34]=[CH:35][C:36]([N:39]5[CH2:44][CH2:43][O:42][CH2:41][CH2:40]5)=[CH:37][CH:38]=4)[C:20](=[O:32])[CH:13]([C:14]([O:16][CH2:17][CH3:18])=[O:15])[C:11]3=[O:12])=[CH:9][C:4]=2[N:3]=[CH:2]1 | 1 |
BrCCO.FC1=CC=C(COCC(=O)NCCCC2=CC=C(C=C2)CN[C@H](CO)CC2=CNC3=CC=CC=C23)C=C1>CC#N.C([O-])([O-])=O.[K+].[K+]>FC1=CC=C(COCC(=O)NCCCC2=CC=C(C=C2)CN(CCO)[C@H](CO)CC2=CNC3=CC=CC=C23)C=C1 | 3 |
COCCBr.FC1=C(C=O)C=C(C(=C1)O)OC>>FC1=C(C=O)C=C(C(=C1)OCCOC)OC | 5 |
F[C:2]1[C:11]([S:12]([CH3:15])(=[O:14])=[O:13])=[CH:10][C:5]([C:6]([O:8][CH3:9])=[O:7])=[C:4]([CH3:16])[CH:3]=1.[F:17][S:18]([F:29])([F:28])([F:27])([F:26])[C:19]1[CH:20]=[C:21]([OH:25])[CH:22]=[CH:23][CH:24]=1.C([O-])([O-])=O.[Cs+].[Cs+]>CN(C=O)C.CC(=O)OCC>[CH3:15][S:12]([C:11]1[C:2]([O:25][C:21]2[CH:22]=[CH:23][CH:24]=[C:19]([S:18]([F:29])([F:17])([F:26])([F:27])[F:28])[CH:20]=2)=[CH:3][C:4]([CH3:16])=[C:5]([CH:10]=1)[C:6]([O:8][CH3:9])=[O:7])(=[O:14])=[O:13] | 1 |
Cl[C:2]([F:7])([F:6])C([O-])=O.[Na+].[OH-].[Na+].[Cl:11][C:12]1[CH:13]=[C:14]([OH:19])[C:15](=[CH:17][CH:18]=1)[OH:16].Cl>C(OCC)(=O)C.O.CN(C)C=O>[Cl:11][C:12]1[CH:18]=[CH:17][C:15]([O:16][CH:2]([F:6])[F:7])=[C:14]([OH:19])[CH:13]=1 | 1 |
C(=O)(OC(C)(C)C)OC(=O)OC(C)(C)C.C(#N)C=1C=C(C=CC1F)C=1C=C2C(=NC1C(CC1=CC(=CC(=C1)F)F)N[S@@](=O)C(C)(C)C)N=C(S2)SC>ClCCl.Cl.C(C)(C)N(C(C)C)CC>C(C)(C)(C)OC(NC(CC1=CC(=CC(=C1)F)F)C1=C(C=C2C(=N1)N=C(S2)SC)C2=CC(=C(C=C2)F)C#N)=O | 3 |
N1=C(C=C2COCCN21)N>O.Cl.[I-].[K+].N(=O)[O-].[Na+]>IC=1C=C2COCCN2N1 | 3 |
C1(C=2C(C(=O)O1)=CC=CC2)=O.N[C@@H](CC1=CC=CC=C1)C(=O)O>>C1=CC=C(C=C1)C[C@@H](C(=O)O)N2C(=O)C3=CC=CC=C3C2=O | 3 |
C(C)(C)(C)OC(=O)N1CCC(CC1)=CC(=O)OCC>>C(C)(C)(C)OC(=O)N1CCC(CC1)=CCO | 5 |
O=C1NCCCC12CCN(CC2)C(=O)OC(C)(C)C.FC(S(=O)(=O)OC=1COC(C1C)=O)(F)F>>CC1=C(COC1=O)N1C(C2(CCC1)CCN(CC2)C(=O)OC(C)(C)C)=O | 5 |
[Cl:1][C:2]1[CH:3]=[C:4]2[C:8](=[CH:9][CH:10]=1)[C:7](=O)[CH2:6][CH2:5]2.[NH:12]1[C:20]2[C:15](=[CH:16][CH:17]=[CH:18][CH:19]=2)[CH2:14][C:13]1=[O:21].N1CCCCC1.O>CN(C)C=O>[Cl:1][C:2]1[CH:3]=[C:4]2[C:8](=[CH:9][CH:10]=1)[C:7](=[C:14]1[C:15]3[C:20](=[CH:19][CH:18]=[CH:17][CH:16]=3)[NH:12][C:13]1=[O:21])[CH2:6][CH2:5]2 | 1 |
C[O-].[Na+].[N+:4]([C:7]1[CH:8]=[C:9]2[C:13](=[CH:14][CH:15]=1)[NH:12][CH:11]=[CH:10]2)([O-:6])=[O:5].O=[C:17]1[CH2:22][CH2:21][N:20]([C:23]([O:25][C:26]([CH3:29])([CH3:28])[CH3:27])=[O:24])[CH2:19][CH2:18]1.C(OCC)(=O)C>CO.CCCCCC.O>[N+:4]([C:7]1[CH:8]=[C:9]2[C:13](=[CH:14][CH:15]=1)[NH:12][CH:11]=[C:10]2[C:17]1[CH2:22][CH2:21][N:20]([C:23]([O:25][C:26]([CH3:29])([CH3:28])[CH3:27])=[O:24])[CH2:19][CH:18]=1)([O-:6])=[O:5] | 2 |
CC1=CC(=CN1C1=CC=CC=C1)C(=O)OCC>O.C1CCCO1.CO[H].Cl.O[Li].O>CC1=CC(=CN1C1=CC=CC=C1)C(=O)O | 3 |
[NH2:1][C:2]1[CH:3]=[CH:4][C:5]([NH:18][CH2:19][CH:20]2[CH2:25][CH2:24][N:23]([C:26]3[CH:31]=[CH:30][N:29]=[CH:28][CH:27]=3)[CH2:22][CH2:21]2)=[C:6]([CH:17]=1)[C:7]([NH:9][C:10]1[CH:15]=[CH:14][C:13]([Cl:16])=[CH:12][N:11]=1)=[O:8].C(N(C(C)C)CC)(C)C.[CH3:41][S:42]([Cl:45])(=[O:44])=[O:43]>C(Cl)Cl>[ClH:16].[ClH:45].[Cl:16][C:13]1[CH:14]=[CH:15][C:10]([NH:9][C:7](=[O:8])[C:6]2[CH:17]=[C:2]([NH:1][S:42]([CH3:41])(=[O:44])=[O:43])[CH:3]=[CH:4][C:5]=2[NH:18][CH2:19][CH:20]2[CH2:21][CH2:22][N:23]([C:26]3[CH:27]=[CH:28][N:29]=[CH:30][CH:31]=3)[CH2:24][CH2:25]2)=[N:11][CH:12]=1 | 1 |
CC(C[C@]1(OC1)C(F)(F)F)(C)C1=C(C=O)C=CC=C1>CC#N.S(N)(O)(=O)=O.Cl(=O)[O-].[Na+]>CC(C[C@]1(OC1)C(F)(F)F)(C)C1=C(C(=O)O)C=CC=C1 | 3 |
C(CCCCCCC)S.FC1=C(C=CC(=C1)OC)CCC(=O)OCC>ClCCl.[Al](Cl)(Cl)Cl>FC1=C(C=CC(=C1)O)CCC(=O)OCC | 3 |
[C:1]([O:5][C:6](=[O:18])[CH2:7][CH2:8][C:9]1[CH:14]=[CH:13][C:12]([OH:15])=[CH:11][C:10]=1[CH2:16][NH2:17])([CH3:4])([CH3:3])[CH3:2].C(N(CC)CC)C.[C:26](Cl)(=[O:33])[C:27]1[CH:32]=[CH:31][CH:30]=[CH:29][CH:28]=1>C(Cl)Cl>[C:1]([O:5][C:6](=[O:18])[CH2:7][CH2:8][C:9]1[CH:14]=[CH:13][C:12]([OH:15])=[CH:11][C:10]=1[CH2:16][NH:17][C:26](=[O:33])[C:27]1[CH:32]=[CH:31][CH:30]=[CH:29][CH:28]=1)([CH3:4])([CH3:2])[CH3:3] | 1 |
[Cl:1][C:2]1[CH:24]=[C:23]([Cl:25])[CH:22]=[CH:21][C:3]=1[CH2:4][N:5]1[C:14](=[O:15])[C:13]2[C:8](=[CH:9][C:10]([C:16]([O:18][CH3:19])=[O:17])=[CH:11][CH:12]=2)[NH:7][C:6]1=[O:20].CI.[C:28](=O)([O-])[O-].[K+].[K+]>CC(C)=O>[Cl:1][C:2]1[CH:24]=[C:23]([Cl:25])[CH:22]=[CH:21][C:3]=1[CH2:4][N:5]1[C:14](=[O:15])[C:13]2[C:8](=[CH:9][C:10]([C:16]([O:18][CH3:19])=[O:17])=[CH:11][CH:12]=2)[N:7]([CH3:28])[C:6]1=[O:20] | 1 |
[CH2:1]([O:8][C:9]1[C:10]([F:36])=[CH:11][C:12]([NH:29][CH:30]2[CH2:35][CH2:34][O:33][CH2:32][CH2:31]2)=[C:13]([CH:28]=1)[C:14]([NH:16][CH2:17][C:18]1[CH:23]=[CH:22][C:21]([O:24][CH3:25])=[C:20]([O:26][CH3:27])[CH:19]=1)=[O:15])[C:2]1[CH:7]=[CH:6][CH:5]=[CH:4][CH:3]=1.Cl[C:38](OC1C=CC([N+]([O-])=O)=CC=1)=[O:39].CCN(C(C)C)C(C)C.C1CCN2C(=NCCC2)CC1>C1COCC1>[CH2:1]([O:8][C:9]1[CH:28]=[C:13]2[C:12](=[CH:11][C:10]=1[F:36])[N:29]([CH:30]1[CH2:35][CH2:34][O:33][CH2:32][CH2:31]1)[C:38](=[O:39])[N:16]([CH2:17][C:18]1[CH:23]=[CH:22][C:21]([O:24][CH3:25])=[C:20]([O:26][CH3:27])[CH:19]=1)[C:14]2=[O:15])[C:2]1[CH:3]=[CH:4][CH:5]=[CH:6][CH:7]=1 | 1 |
FC(C1=CC=C(C=C1)B(O)O)(F)F.BrC1=C(N=C(S1)C)C1=CC=C(C=C1)OC>O.C([O-])([O-])=O.[Na+].[Na+].c1ccc(cc1)[P](c2ccccc2)(c3ccccc3)[Pd]([P](c4ccccc4)(c5ccccc5)c6ccccc6)([P](c7ccccc7)(c8ccccc8)c9ccccc9)[P](c1ccccc1)(c1ccccc1)c1ccccc1>COC1=CC=C(C=C1)C=1N=C(SC1C1=CC=C(C=C1)C(F)(F)F)C | 3 |
Cl.[Cl:2][CH2:3][C:4]1[N:13]=[C:12]([N:14]([C:16]2[CH:21]=[C:20]([Cl:22])[C:19]([O:23][CH3:24])=[C:18]([Cl:25])[CH:17]=2)[CH3:15])[C:11]2[C:6](=[CH:7][CH:8]=[CH:9][CH:10]=2)[N:5]=1.ClC1C2C(=CC=CC=2)N=C(CCl)N=1.Cl.ClC1C=C(NC)C=C(Cl)C=1OC>CC(O)C>[Cl:2][CH2:3][C:4]1[N:13]=[C:12]([N:14]([C:16]2[CH:17]=[C:18]([Cl:25])[C:19]([O:23][CH3:24])=[C:20]([Cl:22])[CH:21]=2)[CH3:15])[C:11]2[C:6](=[CH:7][CH:8]=[CH:9][CH:10]=2)[N:5]=1 | 1 |
[Br:1][C:2]1[CH:7]=[C:6]([Cl:8])[N:5]=[N:4][C:3]=1[NH2:9].Cl[CH2:11][CH:12]=O>C(O)C>[Br:1][C:2]1[C:3]2[N:4]([CH:11]=[CH:12][N:9]=2)[N:5]=[C:6]([Cl:8])[CH:7]=1 | 1 |
C1(=CC=CC=C1)[Si](C1=CC=CC=C1)(C1=CC=CC=C1)Cl.S1C(=NC2=C1C=CC=C2)C2=C(C=CC(=C2)Br)O>C1CCCO1.C(CCC)[Li]>S1C(=NC2=C1C=CC=C2)C2=C(C=CC(=C2)[Si](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)O | 3 |
OC1(CCN(CC1)C(=O)OC(C)(C)C)CC1=NC=C(C=C1)C(F)(F)F>ClCCl.C(O)([O-])=O.[Na+].C(C)N(CC)S(F)(F)F>FC1(CCN(CC1)C(=O)OC(C)(C)C)CC1=NC=C(C=C1)C(F)(F)F | 3 |
ClC=1C=C(C(=CC1)O)C=1C=C(C=CC1)[C@]1(NC(N(C(C1)=O)C)=NC(OC(C)(C)C)=O)C>>ClC=1C=C(C(=CC1)O)C=1C=C(C=CC1)[C@@]1(CC(N(C(N1)=N)C)=O)CC | 5 |
C(CCO)O.O1CC12CCN(CC2)C2=C(C=C(C=C2)N2C(O[C@H](C2)CNC(C)=O)=O)F>>O1CCOCCC12CCN(CC2)C2=C(C=C(C=C2)N2C(O[C@H](C2)CNC(C)=O)=O)F | 5 |
[NH2:1][C:2]1[C:7]([Cl:8])=[CH:6][C:5]([C:9](=[O:18])[CH2:10][CH2:11][CH:12]2[CH2:17][CH2:16][NH:15][CH2:14][CH2:13]2)=[C:4]([O:19][CH3:20])[CH:3]=1.C(N(CC)CC)C.Br[CH2:29][CH2:30][CH3:31]>CN(C=O)C>[NH2:1][C:2]1[C:7]([Cl:8])=[CH:6][C:5]([C:9](=[O:18])[CH2:10][CH2:11][CH:12]2[CH2:13][CH2:14][N:15]([CH2:29][CH2:30][CH3:31])[CH2:16][CH2:17]2)=[C:4]([O:19][CH3:20])[CH:3]=1 | 1 |
BrC1=C(C=C(S1)C=O)C=1C(=NC=CC1)F.CC1=CC=C(C=N1)S(=O)[O-].[Na+]>N(C)(C)C=O.c1ccncc1>FC1=NC=CC=C1C=1C=C(SC1S(=O)(=O)C=1C=NC(=CC1)C)C=O | 3 |
[NH2:1][C:2]1[CH:7]=[CH:6][CH:5]=[CH:4][C:3]=1[C:8]1[NH:9][C:10](=[O:26])[N:11]([CH:13]2[CH2:18][CH2:17][N:16]([CH2:19][C:20]3[CH:25]=[CH:24][CH:23]=[CH:22][CH:21]=3)[CH2:15][CH2:14]2)[CH:12]=1.[CH2:27]=O>C(Cl)(Cl)Cl>[C:20]1([CH2:19][N:16]2[CH2:17][CH2:18][CH:13]([N:11]3[C:12]4[CH:27]=[N:1][C:2]5[CH:7]=[CH:6][CH:5]=[CH:4][C:3]=5[C:8]=4[NH:9][C:10]3=[O:26])[CH2:14][CH2:15]2)[CH:25]=[CH:24][CH:23]=[CH:22][CH:21]=1 | 1 |
CC=1C=C(C(=O)Cl)C=CC1.C(CCC)C1(C(CCC1)O)C(=O)OCC>ClCCl.c1ccncc1>C(CCC)C1(C(CCC1)OC(C1=CC(=CC=C1)C)=O)C(=O)OCC | 3 |
CC1=C2C(NC=NC2=CC=C1)=O>C1(=CC=CC=C1)C.P(=O)(Cl)(Cl)Cl>ClC1=NC=NC2=CC=CC(=C12)C | 3 |
OC1=CC=C(C=N1)C(CC(=O)OCC)C#CC.BrC1=CSC2=C1C=C(C=C2)CBr>C1(=CC=CC=C1)C.C([O-])([O-])=O.[Ag+2]>BrC1=CSC2=C1C=C(C=C2)COC2=CC=C(C=N2)C(CC(=O)OCC)C#CC | 3 |
[CH2:1]([O:3][CH2:4][CH2:5][NH:6][C:7]1[C:12]([N+:13]([O-:15])=[O:14])=[CH:11][CH:10]=[CH:9][N:8]=1)[CH3:2].[Cl:16][CH2:17][C:18](Cl)=[O:19]>O1CCOCC1>[Cl:16][CH2:17][C:18]([N:6]([CH2:5][CH2:4][O:3][CH2:1][CH3:2])[C:7]1[C:12]([N+:13]([O-:15])=[O:14])=[CH:11][CH:10]=[CH:9][N:8]=1)=[O:19] | 1 |
O[C:2]1([C:7]2[CH:12]=[CH:11][C:10]([C:13]3([C:16]([OH:18])=[O:17])[CH2:15][CH2:14]3)=[CH:9][CH:8]=2)[CH2:6][CH2:5][CH2:4][CH2:3]1.C([SiH](CC)CC)C.C(O)(C(F)(F)F)=O>>[CH:2]1([C:7]2[CH:8]=[CH:9][C:10]([C:13]3([C:16]([OH:18])=[O:17])[CH2:14][CH2:15]3)=[CH:11][CH:12]=2)[CH2:3][CH2:4][CH2:5][CH2:6]1 | 1 |
Cl[C:2]1[N:7]=[C:6](Cl)[C:5](F)=[CH:4][N:3]=1.[Cl:10][C:11]1[CH:12]=[C:13]([CH:15]=[CH:16][C:17]=1[F:18])[NH2:14]>>[Cl:10][C:11]1[CH:12]=[C:13]([NH:14][C:2]2[N:7]=[C:6]([NH:14][C:13]3[CH:15]=[CH:16][C:17]([F:18])=[C:11]([Cl:10])[CH:12]=3)[CH:5]=[CH:4][N:3]=2)[CH:15]=[CH:16][C:17]=1[F:18] | 1 |
OC=1C(=C2CCC(OC2=C(C1C)C)(C(=O)O)C)C>N(C)(C)C=O.ClCCl.C(C(=O)Cl)(=O)Cl>C(C)(=O)OC=1C(=C2CCC(OC2=C(C1C)C)(C)C(=O)Cl)C | 3 |
[CH:1]1([S:7]([N:10]2[C:14]([C:15]3[C:16]([F:21])=[N:17][CH:18]=[CH:19][CH:20]=3)=[C:13]([F:22])[C:12]([CH2:23][N:24](C)[C:25](=O)OC(C)(C)C)=[CH:11]2)(=[O:9])=[O:8])[CH2:6][CH2:5][CH2:4][CH2:3][CH2:2]1.C(OCC)(=O)C.[ClH:39]>CO>[ClH:39].[CH:1]1([S:7]([N:10]2[C:14]([C:15]3[C:16]([F:21])=[N:17][CH:18]=[CH:19][CH:20]=3)=[C:13]([F:22])[C:12]([CH2:23][NH:24][CH3:25])=[CH:11]2)(=[O:9])=[O:8])[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1 | 1 |
C1N=C[N:3]([C:6]([N:8]2C=N[CH:10]=[CH:9]2)=[O:7])C=1.[F:13][C:14]1[C:19]2[CH2:20][CH2:21][C:22]3[CH:27]=[CH:26][N:25]=[CH:24]C=3C(N)[C:18]=2[CH:17]=[CH:16][CH:15]=1.[Cl:30][C:31]1[CH:32]=[C:33]([C:39]([OH:41])=[O:40])[CH:34]=[N:35][C:36]=1[NH:37]N>CN(C=O)C>[Cl:30][C:31]1[CH:32]=[C:33]([C:39]([OH:41])=[O:40])[CH:34]=[N:35][C:36]=1[NH:37][NH:3][C:6]([NH:8][CH:9]1[C:10]2[CH:24]=[N:25][CH:26]=[CH:27][C:22]=2[CH2:21][CH2:20][C:19]2[C:14]([F:13])=[CH:15][CH:16]=[CH:17][C:18]1=2)=[O:7] | 2 |
C([O-])([O-])=O.[K+].[K+].[CH2:7](Br)[C:8]1[CH:13]=[CH:12][CH:11]=[CH:10][CH:9]=1.[CH:15]1[C:27]2[NH:26][C:25]3[C:20](=[CH:21][CH:22]=[CH:23][CH:24]=3)[C:19]=2[CH:18]=[CH:17][C:16]=1[OH:28].O>CN(C=O)C>[CH2:7]([O:28][C:16]1[CH:17]=[CH:18][C:19]2[C:20]3[C:25](=[CH:24][CH:23]=[CH:22][CH:21]=3)[NH:26][C:27]=2[CH:15]=1)[C:8]1[CH:13]=[CH:12][CH:11]=[CH:10][CH:9]=1 | 2 |
ClC1=C(C=NC=C1I)N.C(C)(C)(C)OC(=O)NC=1C(=C(C=C2C=C(N=CC12)NC1=NN2CC(N(CCC2=C1)C)=O)B(O)O)F>CC#N.O.C(C)(=O)[O-].[Na+].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].P(=O)([O-])([O-])[O-].[K+].[K+].[K+]>NC=1C(=C(C=NC1)C=1C=C2C=C(N=CC2=C(C1F)NC(OC(C)(C)C)=O)NC1=NN2CC(N(CCC2=C1)C)=O)Cl | 3 |
[CH3:1][C@@H:2]1[CH2:7][CH2:6][CH2:5][CH2:4][C@@H:3]1[NH:8][C:9]1[C:10]2[N:11]([CH:18]=[C:19]([N+:21]([O-])=O)[CH:20]=2)[N:12]=[CH:13][C:14]=1[C:15]([NH2:17])=[O:16]>CCO.C(OCC)(=O)C.[Pd]>[NH2:21][C:19]1[CH:20]=[C:10]2[C:9]([NH:8][C@H:3]3[CH2:4][CH2:5][CH2:6][CH2:7][C@H:2]3[CH3:1])=[C:14]([C:15]([NH2:17])=[O:16])[CH:13]=[N:12][N:11]2[CH:18]=1 | 2 |
C([O:5][N:6]=[C:7]1[C:16]2[C:11](=[CH:12][CH:13]=[C:14]([OH:17])[CH:15]=2)[O:10][C:9]([C:18]2[N:23]=[CH:22][N:21]3[CH:24]=[CH:25][CH:26]=[C:20]3[CH:19]=2)=[CH:8]1)(C)(C)C.Br[CH2:28][C:29]([NH:31][C:32]1[CH:37]=[CH:36][C:35]([F:38])=[CH:34][CH:33]=1)=[O:30]>>[F:38][C:35]1[CH:34]=[CH:33][C:32]([NH:31][C:29](=[O:30])[CH2:28][O:17][C:14]2[CH:15]=[C:16]3[C:11](=[CH:12][CH:13]=2)[O:10][C:9]([C:18]2[N:23]=[CH:22][N:21]4[CH:24]=[CH:25][CH:26]=[C:20]4[CH:19]=2)=[CH:8][C:7]3=[N:6][OH:5])=[CH:37][CH:36]=1 | 1 |
[CH2:1]([O:8][C:9]1[CH:25]=[CH:24][CH:23]=[CH:22][C:10]=1[CH2:11][S:12][C:13]1[CH:21]=[CH:20][C:16]([C:17](O)=[O:18])=[CH:15][CH:14]=1)[C:2]1[CH:7]=[CH:6][CH:5]=[CH:4][CH:3]=1.C(Cl)(=O)C([Cl:29])=O>ClCCl>[CH2:1]([O:8][C:9]1[CH:25]=[CH:24][CH:23]=[CH:22][C:10]=1[CH2:11][S:12][C:13]1[CH:21]=[CH:20][C:16]([C:17]([Cl:29])=[O:18])=[CH:15][CH:14]=1)[C:2]1[CH:7]=[CH:6][CH:5]=[CH:4][CH:3]=1 | 1 |
CON(C(=O)[C@@]1(OC(OC1)(C)C)C)C>>CC1(OC[C@@](O1)(C=O)C)C | 5 |
ClC1=NC=C(C(=N1)Cl)[N+](=O)[O-].NC=1C=C(C=CC1F)NC(OC(C)(C)C)=O>C1CCCO1.C(C)(C)N(C(C)C)CC>ClC1=NC=C(C(=N1)NC=1C=C(C=CC1F)NC(OC(C)(C)C)=O)[N+](=O)[O-] | 3 |
[OH:1][C@@H:2]1[CH2:6][C@H:5]([OH:7])[C@H:4]([CH2:8]/[CH:9]=[CH:10]\[CH2:11][CH2:12][CH2:13][CH2:14][CH2:15][C:16]([OH:18])=[O:17])[C@H:3]1[CH2:19][CH2:20][CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][CH2:26][CH2:27][CH3:28].[CH:29](I)([CH3:31])[CH3:30].C1CCN2C(=NCCC2)CC1>C(#N)C>[OH:1][C@@H:2]1[CH2:6][C@H:5]([OH:7])[C@H:4]([CH2:8]/[CH:9]=[CH:10]\[CH2:11][CH2:12][CH2:13][CH2:14][CH2:15][C:16]([O:18][CH:29]([CH3:31])[CH3:30])=[O:17])[C@H:3]1[CH2:19][CH2:20][CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][CH2:26][CH2:27][CH3:28] | 1 |
N1=CC(=CC=C1)B1OC(C)(C)C(C)(C)O1.BrC1=C(C(=CC=C1)[N+](=O)[O-])NC(C)=O>>[N+](=O)([O-])C1=C(C(=CC=C1)C=1C=NC=CC1)NC(C)=O | 5 |
COC(=O)C1(CCN(CC1)C)NC(=O)C=1C=2C[C@@H]3[C@H](C2N(N1)C1=C(C=C(C=C1)F)F)C3>C1CCCO1.CO[H].[OH-].[Na+].[BH4-].[Li+]>OCC(C)(C)NC(=O)C=1C=2C[C@@H]3[C@H](C2N(N1)C1=NC=C(N=C1)C(C(F)(F)F)(F)F)C3 | 3 |
COC1=CC=C(CCl)C=C1.C(C)C1=NN(C2=NC(=CC=C21)Cl)CC>CC#N.C([O-])([O-])=O.[K+].[K+]>ClC1=CC=C2C(=N1)N(N=C2)CC2=CC=C(C=C2)OC | 3 |
O=C(CNC(OC(C)(C)C)=O)NC=1SC=C(N1)C1=CC=CC=C1>ClCCl.Cl.O1CCOCC1>NCC(=O)NC=1SC=C(N1)C1=CC=CC=C1 | 3 |
BrC1=CN(C2=C1C=NC(=C2)NC(C2=CC=C(C=C2)C(=C)C)=O)C>O.C(C)(C)(C)O.CS(=O)(=O)N.CCC1CN2CCC1CC2C(C3=C4C=C(C=CC4=NC=C3)OC)OC5=NN=C(C6=CC=CC=C65)OC(C7CC8CCN7CC8CC)C9=C1C=C(C=CC1=NC=C9)OC.[K+].[K+].[O-][Os](O)(O)(O)(O)[O-].[K+].[K+].N#C[Fe-3](C#N)(C#N)(C#N)(C#N)C#N.[K+].C(=O)([O-])[O-].[K+].[K+]>BrC1=CN(C2=C1C=NC(=C2)NC(C2=CC=C(C=C2)[C@@](CO)(C)O)=O)C | 3 |
C(C)OC(C(C(=O)OCC)=COCC)=O.NC1=NNC=C1>CCO[H].C(C)(=O)O>C(C)OC(=O)C=1C=NC=2N(C1O)N=CC2 | 3 |
C(C)(C)(C)OC(=O)N[C@@H](C(=O)O)CC1=CC=C(C=C1)OC.Cl.COC=1C=C(C=CC1OC)C1=NN(C([C@@H]2CCCC[C@H]12)=O)C1CCNCC1>>COC=1C=C(C=CC1OC)C1=NN(C([C@@H]2CCCC[C@H]12)=O)C1CCN(CC1)C([C@@H](CC1=CC=C(C=C1)OC)NC(OC(C)(C)C)=O)=O | 5 |
C1(CCCC1)C=CC(CC(=O)OCC)C>C(C)OCC.[H-].[Al+3].[Li+].[H-].[H-].[H-]>C1(CCCC1)C=CC(CCO)C | 3 |
[CH:1]1([C:13]([OH:15])=[O:14])[CH2:6][CH2:5][CH:4]([C:7]([OH:9])=[O:8])[CH2:3][CH:2]1[C:10]([OH:12])=O.C(OC(=O)C)(=O)C>C(O)(=O)C>[CH:1]12[C:13](=[O:14])[O:15][C:10](=[O:12])[CH:2]1[CH2:3][CH:4]([C:7]([OH:9])=[O:8])[CH2:5][CH2:6]2 | 1 |
ClC1=NC=CC(=C1)C#C[Si](C)(C)C.[N+](=O)([O-])C1=C(C=C(C=C1)N1CCCCC1)B1OC(C(O1)(C)C)(C)C>>C(#C)C1=CC(=NC=C1)C1=C(C=CC(=C1)N1CCCCC1)[N+](=O)[O-] | 5 |
Br[C:2]1[CH:7]=[CH:6][N:5]=[CH:4][C:3]=1[CH3:8].CC1C=C([B:16]2[O:24][C:21]([CH3:23])([CH3:22])[C:18]([CH3:20])([CH3:19])[O:17]2)C=CN=1>>[CH3:8][C:3]1[CH:4]=[N:5][CH:6]=[CH:7][C:2]=1[B:16]1[O:24][C:21]([CH3:23])([CH3:22])[C:18]([CH3:20])([CH3:19])[O:17]1 | 2 |
BrC=1C=NNC1.CS(=O)(=O)OCC[C@H](CC1=CC=C(C=C1)Cl)NC(=O)OC(C)(C)C>N(C)(C)C=O.ClCCl.C(=O)([O-])[O-].[Cs+].[Cs+]>BrC=1C=NN(C1)CC[C@H](CC1=CC=C(C=C1)Cl)NC(OC(C)(C)C)=O | 3 |
[CH3:1][O:2][C:3]([C:5]1[CH:6]=[C:7]2[C:12](=[CH:13][CH:14]=1)[NH:11][CH:10]([C:15]1[CH:20]=[CH:19][C:18]([N+:21]([O-])=O)=[CH:17][CH:16]=1)[C:9]([CH3:25])([CH3:24])[CH2:8]2)=[O:4]>CO.O.[Fe]>[NH2:21][C:18]1[CH:17]=[CH:16][C:15]([CH:10]2[C:9]([CH3:24])([CH3:25])[CH2:8][C:7]3[C:12](=[CH:13][CH:14]=[C:5]([C:3]([O:2][CH3:1])=[O:4])[CH:6]=3)[NH:11]2)=[CH:20][CH:19]=1 | 1 |
[CH:1]1([C:7]2[CH:12]=[CH:11][C:10]([S:13][CH2:14][CH2:15][CH2:16][CH2:17][O:18][C:19]3[CH:20]=[CH:21][C:22]4[NH:27][C:26](=[O:28])[O:25][CH2:24][C:23]=4[CH:29]=3)=[CH:9][CH:8]=2)[CH2:6][CH2:5][CH2:4][CH2:3][CH2:2]1.[OH:30]O>>[CH:1]1([C:7]2[CH:8]=[CH:9][C:10]([S:13]([CH2:14][CH2:15][CH2:16][CH2:17][O:18][C:19]3[CH:20]=[CH:21][C:22]4[NH:27][C:26](=[O:28])[O:25][CH2:24][C:23]=4[CH:29]=3)=[O:30])=[CH:11][CH:12]=2)[CH2:6][CH2:5][CH2:4][CH2:3][CH2:2]1 | 1 |
C1(CC1)C(=O)NC=1SC2=C(C1C(NCC(C)C)=O)CC(CC2)NC(OC(C)(C)C)=O>CCO[H].Cl.O1CCOCC1>NC1CCC2=C(C(=C(S2)NC(=O)C2CC2)C(=O)NCC(C)C)C1 | 3 |
ClC(COC(=O)Cl)(Cl)Cl.NC1=CC(=NN1C)C(C)(C)C>C1CCCO1.c1ccncc1>ClC(COC(NC=1N(N=C(C1)C(C)(C)C)C)=O)(Cl)Cl | 3 |
[I:1][C:2]1[C:3]([C:7]2[S:8][CH:9]=[C:10]([Cl:12])[CH:11]=2)=[N:4][NH:5][CH:6]=1.[H-].[Na+].I[CH:16]([CH2:18][CH3:19])[CH3:17].C(N1C=C(I)C(C2SC=C(Cl)C=2)=N1)(CC)C>CN(C)C=O.CC(OC)(C)C.O>[CH:16]([N:4]1[C:3]([C:7]2[S:8][CH:9]=[C:10]([Cl:12])[CH:11]=2)=[C:2]([I:1])[CH:6]=[N:5]1)([CH2:18][CH3:19])[CH3:17] | 1 |
[CH2:1]([N:8]1[CH:12]=[C:11]([C:13]([O:15][CH2:16][CH3:17])=[O:14])[C:10]([O:18][CH2:19][C:20]2[CH:25]=[CH:24][C:23]([O:26][CH2:27][C:28]3[N:29]=[C:30]([C:34]4[O:35][CH:36]=[CH:37][CH:38]=4)[O:31][C:32]=3[CH3:33])=[C:22](Br)[CH:21]=2)=[N:9]1)[C:2]1[CH:7]=[CH:6][CH:5]=[CH:4][CH:3]=1.[CH2:40]([Sn](CC)(CC)CC)[CH3:41]>C1C=CC([P]([Pd]([P](C2C=CC=CC=2)(C2C=CC=CC=2)C2C=CC=CC=2)([P](C2C=CC=CC=2)(C2C=CC=CC=2)C2C=CC=CC=2)[P](C2C=CC=CC=2)(C2C=CC=CC=2)C2C=CC=CC=2)(C2C=CC=CC=2)C2C=CC=CC=2)=CC=1.C1(C)C=CC=CC=1>[CH2:1]([N:8]1[CH:12]=[C:11]([C:13]([O:15][CH2:16][CH3:17])=[O:14])[C:10]([O:18][CH2:19][C:20]2[CH:25]=[CH:24][C:23]([O:26][CH2:27][C:28]3[N:29]=[C:30]([C:34]4[O:35][CH:36]=[CH:37][CH:38]=4)[O:31][C:32]=3[CH3:33])=[C:22]([CH2:40][CH3:41])[CH:21]=2)=[N:9]1)[C:2]1[CH:7]=[CH:6][CH:5]=[CH:4][CH:3]=1 | 1 |
SCC(C)O.ClC=1N=C(C2=C(N1)SC(=C2)CC)N2CCN(CC2)C(CC2=CC=CC=C2)=O>>C(C)C1=CC2=C(N=C(N=C2N2CCN(CC2)C(CC2=CC=CC=C2)=O)SCC(C)O)S1 | 5 |
[S:1]1[C:5]([C:6]2[O:7][C:8]3[C:9](=[C:11]([C:15]([OH:17])=O)[CH:12]=[CH:13][CH:14]=3)[N:10]=2)=[CH:4][C:3]2[CH:18]=[CH:19][CH:20]=[CH:21][C:2]1=2.Cl.Cl.[NH2:24][CH:25]1[CH2:32][CH:31]2[N:33]([CH3:34])[CH:27]([CH2:28][CH2:29][CH2:30]2)[CH2:26]1.Cl.C(N=C=NCCCN(C)C)C.ON1C2C=CC=CC=2N=N1.C(N(CC)CC)C>CN(C=O)C.C(OCC)(=O)C>[CH3:34][N:33]1[CH:27]2[CH2:28][CH2:29][CH2:30][CH:31]1[CH2:32][CH:25]([NH:24][C:15]([C:11]1[CH:12]=[CH:13][CH:14]=[C:8]3[O:7][C:6]([C:5]4[S:1][C:2]5[CH:21]=[CH:20][CH:19]=[CH:18][C:3]=5[CH:4]=4)=[N:10][C:9]=13)=[O:17])[CH2:26]2 | 1 |
COC(C1=NC2=NC=CC=C2C=C1)OC>CCO[H].[HH].[Pt](=O)=O>COC(C1=NC=2NCCCC2C=C1)OC | 3 |
ICC(C)C.COC(C1=CC(=CC=C1)S)=O>>COC(C1=CC(=CC=C1)SCC(C)C)=O | 5 |
Cl.Cl.CC1=NC=C2N1C(N(C2)C2CCNCC2)=O.C(C)(C)(C)OC(=O)NC(C(=O)O)CCCC>CC#N.CCN(CC)CC.OC1=CC=CC=2NN=NC21.C1CCC2=NCCCN2CC1.CCN=C=NCCCN(C)C>CC1=NC=C2N1C(N(C2)C2CCN(CC2)C(=O)C(CCCC)NC(OC(C)(C)C)=O)=O | 3 |
FC(S(=O)(=O)O[Si](C)(C)C(C)(C)C)(F)F.C(C1=CC=CC=C1)ON1C(N2[C@@H](C3=C([C@@H]1C2)C=NN3C)/C(/N(NC(=O)OC(C)(C)C)C)=N/O)=O>C1(=NC(=CC=C1)C)C.ClCCl.[Cl-].[NH4+]>C(C1=CC=CC=C1)ON1C(N2[C@@H](C3=C([C@@H]1C2)C=NN3C)/C(/N(NC(=O)OC(C)(C)C)C)=N/O[Si](C(C)(C)C)(C)C)=O | 3 |
C(=O)(O)CC1=CC=C(CCCNC2=C(C=CC(=C2)OC)C2CC=3C=CC(=CC3CC2)OC(C(C)(C)C)=O)C=C1>N(C)(C)C=O.C1CCCO1.C(C(=O)Cl)(=O)Cl>ClC(=O)CC1=CC=C(CCCNC2=C(C=CC(=C2)OC)C2CC=3C=CC(=CC3CC2)OC(C(C)(C)C)=O)C=C1 | 3 |
[Zn](CC)[CH2:2]C.C(O)(C(F)(F)F)=O.ICI.[CH3:16][O:17][C:18](=[O:32])[C:19]1[CH:24]=[C:23]([O:25][CH3:26])[C:22]([O:27][CH3:28])=[C:21]([CH2:29][CH:30]=[CH2:31])[CH:20]=1>C(Cl)Cl>[CH3:16][O:17][C:18](=[O:32])[C:19]1[CH:24]=[C:23]([O:25][CH3:26])[C:22]([O:27][CH3:28])=[C:21]([CH2:29][CH:30]2[CH2:2][CH2:31]2)[CH:20]=1 | 1 |
[CH3:1][O:2][C:3](=[O:17])[C@@H:4]([O:14][CH2:15][CH3:16])[CH2:5][C:6]1[CH:11]=[CH:10][C:9]([OH:12])=[CH:8][C:7]=1[Cl:13].Cl[CH2:19][C:20]1[N:21]=[C:22]([C:26]2[CH:31]=[CH:30][C:29]([O:32][CH:33]([CH3:35])[CH3:34])=[CH:28][CH:27]=2)[O:23][C:24]=1[CH3:25].C(=O)([O-])[O-].[Cs+].[Cs+].[I-].[K+]>>[CH3:1][O:2][C:3](=[O:17])[C@@H:4]([O:14][CH2:15][CH3:16])[CH2:5][C:6]1[CH:11]=[CH:10][C:9]([O:12][CH2:19][C:20]2[N:21]=[C:22]([C:26]3[CH:31]=[CH:30][C:29]([O:32][CH:33]([CH3:35])[CH3:34])=[CH:28][CH:27]=3)[O:23][C:24]=2[CH3:25])=[CH:8][C:7]=1[Cl:13] | 1 |
OCCCC1(CCN(CC1)C(=O)OC(C)(C)C)C(=O)OCC>c3c(P(c1ccccc1)c2ccccc2)cccc3.ClCCl.C(Br)(Br)(Br)Br>C(C)OC(=O)C1(CCN(CC1)C(=O)OC(C)(C)C)CCCBr | 3 |
[N+:1]([C:4]1[CH:5]=[C:6]([CH:10]=[CH:11][CH:12]=1)C(Cl)=O)([O-])=O.[CH2:13]([O:20][C:21](=[O:25])[C@@H:22]([CH3:24])N)[C:14]1[CH:19]=[CH:18][CH:17]=[CH:16][CH:15]=1.[Sn](Cl)(Cl)(Cl)Cl>>[CH2:13]([O:20][C:21](=[O:25])[C@@H:22]([C:11]1[CH:10]=[CH:6][CH:5]=[C:4]([NH2:1])[CH:12]=1)[CH3:24])[C:14]1[CH:19]=[CH:18][CH:17]=[CH:16][CH:15]=1 | 1 |
C(C)C(=O)C.C(C1=CC=CC=C1)C(COCC(CC1=CC=CC=C1)Br)Br.C1=COC=2C1=C(C3=C(C2)OC(=O)C=C3)O>>C(C1=CC=CC=C1)OCCOC1=C2C(=CC3=C1C=CC(O3)=O)OC=C2 | 5 |
B(Br)(Br)Br.C[O:6][C:7]1[CH:12]=[CH:11][C:10]([CH3:13])=[CH:9][C:8]=1[C:14]1[CH:19]=[CH:18][CH:17]=[C:16]([C:20]#[N:21])[CH:15]=1>C(Cl)Cl>[OH:6][C:7]1[CH:12]=[CH:11][C:10]([CH3:13])=[CH:9][C:8]=1[C:14]1[CH:19]=[CH:18][CH:17]=[C:16]([C:20]#[N:21])[CH:15]=1 | 2 |
FC1=CC=C(OC2CCN(CC2)C(=O)NC(C(=O)O)C(C)C2=CNC3=CC=CC=C23)C=C1.FC(C(=O)NCC1=CC(=CC=C1)NC)(F)F>CC#N.C1CCCO1.OC1=CC=CC=2NN=NC21.CCN=C=NCCCN(C)C>FC1=CC=C(OC2CCN(CC2)C(=O)NC(C(C)C2=CNC3=CC=CC=C23)C(=O)N(C2=CC(=CC=C2)CNC(C(F)(F)F)=O)C)C=C1 | 3 |
[NH2:1][C:2]1[CH2:7][CH2:6][CH2:5][C:4](=[O:8])[CH:3]=1.C(O[CH:12](OCC)[CH2:13][CH:14](OCC)OCC)C.C1(C)C=CC(S(O)(=O)=O)=CC=1>CN(C=O)C>[N:1]1[C:2]2[CH2:7][CH2:6][CH2:5][C:4](=[O:8])[C:3]=2[CH:14]=[CH:13][CH:12]=1 | 2 |
[Cl:1][C:2]1[C:7]([F:8])=[CH:6][N:5]=[C:4]([CH:9]2[CH2:11][CH:10]2[CH2:12][CH:13]=O)[C:3]=1[CH3:15].N1CCCCC1.C(O)(=O)C.[C:26]([O:34]CC)(=O)[CH2:27][C:28]([O:30][CH2:31][CH3:32])=[O:29]>C(O)C.C1C=CC(C2C=CC=CC=2)=CC=1.C1C=CC(OC2C=CC=CC=2)=CC=1>[CH2:31]([O:30][C:28]([C:27]1[C:26](=[O:34])[N:5]2[C:4]([C:3]([CH3:15])=[C:2]([Cl:1])[C:7]([F:8])=[CH:6]2)=[C:9]([CH:10]2[CH2:12][CH2:13]2)[CH:11]=1)=[O:29])[CH3:32] | 1 |
FC(C1=CC=C(C=C1)C1=C2C=CC(=CC2=CC=C1)C(=O)O)(F)F.N1=CNC2=C1C=CC=C2C(C)N>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>N1=CNC2=C1C=CC=C2C(C)NC(=O)C2=CC1=CC=CC(=C1C=C2)C2=CC=C(C=C2)C(F)(F)F | 3 |
[Br:1][C:2]1[CH:3]=[N:4][C:5](Cl)=[C:6]([CH:11]=1)[C:7]([O:9][CH3:10])=[O:8].Cl.[CH3:14][S:15]([CH2:18][CH2:19][NH2:20])(=[O:17])=[O:16].CN1C(=O)CCC1.C(N(CC)C(C)C)(C)C>O>[Br:1][C:2]1[CH:3]=[N:4][C:5]([NH:20][CH2:19][CH2:18][S:15]([CH3:14])(=[O:17])=[O:16])=[C:6]([CH:11]=1)[C:7]([O:9][CH3:10])=[O:8] | 2 |
[CH2:1]([C:3]1[C:11]2[N:10]=[CH:9][N:8]([C:12]([O:14][C:15]([CH3:18])([CH3:17])[CH3:16])=[O:13])[C:7]=2[CH:6]=[CH:5][C:4]=1[N+:19]([O-])=O)[CH3:2]>CO.[Pd]>[NH2:19][C:4]1[CH:5]=[CH:6][C:7]2[N:8]([C:12]([O:14][C:15]([CH3:16])([CH3:17])[CH3:18])=[O:13])[CH:9]=[N:10][C:11]=2[C:3]=1[CH2:1][CH3:2] | 1 |
ClC1=C(C=C(C=C1)N1CCC(CC1)(C(=O)OC)C)OC>>ClC1=C(C=C(C=C1)N1CCC(CC1)(C)CO)OC | 5 |
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