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ReactionSmiles

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 Community
1
smiles
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15
6.12k
source_id
int64
1
5
[C:1]([CH2:3][C:4]1[CH:9]=[CH:8][C:7]([NH:10][S:11]([CH3:14])(=[O:13])=[O:12])=[C:6]([F:15])[C:5]=1[CH3:16])#[N:2].[CH2:17](N)[CH2:18][NH2:19]>C(=S)=S.CO>[NH:2]1[CH2:17][CH2:18][N:19]=[C:1]1[CH2:3][C:4]1[CH:9]=[CH:8][C:7]([NH:10][S:11]([CH3:14])(=[O:12])=[O:13])=[C:6]([F:15])[C:5]=1[CH3:16]
2
C(C)(C)(C)C1=CC=C(CBr)C=C1.CN1N=C2C=CC(=CC2=C1C)N1C(C=C(C=C1)O)=O>N(C)(C)C=O.C([O-])([O-])=O.[K+].[K+]>C(C)(C)(C)C1=CC=C(COC2=CC(N(C=C2)C2=CC3=C(N(N=C3C=C2)C)C)=O)C=C1
3
C(OCC[Si](C)(C)C)Cl.BrC=1C(=NNC1)[N+](=O)[O-]>>BrC=1C(=NN(C1)COCC[Si](C)(C)C)[N+](=O)[O-]
5
C(#N)C1=C(N(C=2N([C@@H]1C1=CC=C(C=C1)C#N)N=C(N2)NC(CNC(OC(C)(C)C)=O)=O)C2=CC(=CC=C2)C(F)(F)F)C>ClCCl.C(=O)(C(F)(F)F)O>FC(C(=O)O)(F)F.C(#N)C1=C(N(C=2N([C@@H]1C1=CC=C(C=C1)C#N)N=C(N2)NC(CN)=O)C2=CC(=CC=C2)C(F)(F)F)C
3
ClC1=C(CCl)C(=CC(=C1)[N+](=O)[O-])Cl>O.COCCO.C([O-])([O-])=O.[Ag+2]>ClC1=C(CO)C(=CC(=C1)[N+](=O)[O-])Cl
3
N1(N(C=CC=C1)C(=O)OCC)C(=O)OCC>C1(=CC=CC=C1)C>[C@@H]12N(N([C@H]2C=C1)C(=O)OCC)C(=O)OCC
3
ClC=1C=C(C=CC1Cl)S(=O)(=O)N1[C@@H](C(NC2=CC=CC=C12)=O)CC(=O)O.N1=C(C=CC=2CCCNC12)CCCCO>>ClC=1C=C(C=CC1Cl)S(=O)(=O)N1[C@@H](C(NC2=CC=CC=C12)=O)CC(=O)OCCCCC1=NC=2NCCCC2C=C1
5
[CH2:1]([O:8][NH:9][C:10]([NH:12][C:13]([C:16]1[CH:21]=[C:20]([S:22][CH3:23])[CH:19]=[CH:18][N:17]=1)([CH3:15])[CH3:14])=[O:11])[C:2]1[CH:7]=[CH:6][CH:5]=[CH:4][CH:3]=1.[H-].[Na+].[CH2:26](I)[CH3:27].[Cl-].[NH4+]>CN(C)C=O>[CH2:1]([O:8][N:9]([CH2:26][CH3:27])[C:10]([NH:12][C:13]([C:16]1[CH:21]=[C:20]([S:22][CH3:23])[CH:...
2
C(C(C)C)N.ClCCSC1=C(C=C(C(=O)Cl)C=C1)[N+](=O)[O-]>>ClCCSC1=C(C=C(C(=O)NCC(C)C)C=C1)[N+](=O)[O-]
5
C(NC(C)C)(C)C.C([Li])CCC.CCCCCC.[CH2:19]([P:25](=[O:32])([O:29][CH2:30][CH3:31])[O:26][CH2:27][CH3:28])[CH2:20][CH2:21][CH2:22][CH2:23][CH3:24].[C:33](OCC)(=[O:35])[CH3:34]>O1CCCC1>[O:35]=[C:33]([CH:19]([P:25](=[O:32])([O:26][CH2:27][CH3:28])[O:29][CH2:30][CH3:31])[CH2:20][CH2:21][CH2:22][CH2:23][CH3:24])[CH3:34]
2
Br[CH2:2][CH2:3][CH2:4][C:5]([CH3:17])([C:11]1[CH:16]=[CH:15][CH:14]=[CH:13][CH:12]=1)[C:6]([O:8][CH2:9][CH3:10])=[O:7].[C:18]1([CH3:30])[CH:23]=[CH:22][C:21]([S:24]([CH2:27][N+:28]#[C-:29])(=[O:26])=[O:25])=[CH:20][CH:19]=1.[H-].[Na+]>CS(C)=O.C(OCC)C>[CH2:9]([O:8][C:6](=[O:7])[C:5]([CH3:17])([C:11]1[CH:16]=[CH:15][CH:...
1
CN1CCNCC1.BrCCCC#N>CC#N.C([O-])([O-])=O.[K+].[K+]>CN1CCN(CC1)CCCC#N
3
C(C1=CC=CC=C1)OC1=CC=C(C=C1)C#C.C1(CC1)C=1C(=C(C=O)C=CC1OC)OC>C1CCCO1.C(CCC)[Li]>C1(CC1)C=1C(=C(C=CC1OC)C(C#CC1=CC=C(C=C1)OCC1=CC=CC=C1)O)OC
3
N1CCOCC1.C([O:10][C:11]1[C:23]([C:24]([F:27])([F:26])[F:25])=[CH:22][CH:21]=[C:20]([CH2:28][O:29][C:30]2[CH:35]=[CH:34][C:33]([C:36]3[CH:41]=[CH:40][C:39]([C:42]([C:47]([O:49][CH2:50][CH:51]=[CH2:52])=[O:48])=[CH:43][N:44]([CH3:46])[CH3:45])=[C:38]([F:53])[CH:37]=3)=[CH:32][CH:31]=2)[C:12]=1[C:13]([O:15][C:16]([CH3:19]...
1
C([Li])CCC.[Br:6][C:7]1[CH:19]=[CH:18][C:17]2[C:16]3[C:11](=[CH:12][C:13](Br)=[CH:14][CH:15]=3)[C:10]([CH2:29][CH2:30][CH2:31][CH2:32][CH2:33][CH2:34][CH2:35][CH3:36])([CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][CH2:26][CH2:27][CH3:28])[C:9]=2[CH:8]=1.C[O:38]B(OC)OC.Cl>O1CCCC1>[Br:6][C:7]1[CH:19]=[CH:18][C:17]2[C:16]3[C:1...
1
[F:1][C:2]1[C:11]2[CH2:10][N:9]([C@H:12]([CH:16]([CH3:18])[CH3:17])[C:13]([OH:15])=O)[C:8](=[O:19])[C:7]3=[CH:20][NH:21][C:5]([C:6]=23)=[N:4][CH:3]=1.C1C=C2N=NN(O)C2=CC=1.O.CCN=C=NCCCN(C)C.Cl.[F:45][CH:46]([F:51])[CH:47]1[CH2:50][NH:49][CH2:48]1.CN1CCOCC1>CN(C=O)C>[F:45][CH:46]([F:51])[CH:47]1[CH2:50][N:49]([C:13](=[O:...
1
C(C1=CC=CC=C1)OC1=C(C=C2C(=NC=NC2=C1)NC=1C=CC(=NC1)NC(C1=CC(=CC=C1)Cl)=O)OC>>ClC=1C=C(C(=O)NC2=NC=C(C=C2)NC2=NC=NC3=CC(=C(C=C23)OC)O)C=CC1
5
Cl[C:2]1[N:3]([CH:12]([CH3:14])[CH3:13])[C:4]2[CH:9]=[C:8]([Cl:10])[N:7]=[CH:6][C:5]=2[N:11]=1.[CH3:15][O:16][CH2:17][CH2:18][NH2:19]>CC(N(C)C)=O.O>[Cl:10][C:8]1[N:7]=[CH:6][C:5]2[N:11]=[C:2]([NH:19][CH2:18][CH2:17][O:16][CH3:15])[N:3]([CH:12]([CH3:14])[CH3:13])[C:4]=2[CH:9]=1
2
[H-].[Na+].[N+:3]([C:6]1[CH:11]=[C:10]([C:12]([OH:21])([C:17]([F:20])([F:19])[F:18])[C:13]([F:16])([F:15])[F:14])[CH:9]=[CH:8][C:7]=1[CH2:22][CH2:23][C:24]([N:26]([CH3:28])[CH3:27])=[O:25])([O-:5])=[O:4].CI.[CH2:31](O)C>CN(C)C=O.O>[N+:3]([C:6]1[CH:11]=[C:10]([C:12]([O:21][CH3:31])([C:13]([F:14])([F:15])[F:16])[C:17]([F...
1
[Cl:1][C:2]1[N:10]=[C:9]2[C:5]([NH:6][CH:7]=[N:8]2)=[C:4]([NH:11][C:12]2[CH:17]=[CH:16][CH:15]=[CH:14][CH:13]=2)[N:3]=1.C([O-])([O-])=O.[K+].[K+].[CH2:24](I)[CH3:25]>CN(C=O)C>[Cl:1][C:2]1[N:10]=[C:9]2[C:5]([N:6]=[CH:7][N:8]2[CH2:24][CH3:25])=[C:4]([NH:11][C:12]2[CH:17]=[CH:16][CH:15]=[CH:14][CH:13]=2)[N:3]=1
1
CS(=O)(=O)Cl.OCCCC1C(NC2=CC=CC=C12)=O>ClCCl.CCN(CC)CC>CS(=O)(=O)OCCCC1C(NC2=CC=CC=C12)=O
3
BrC1=C(C=C(CO)C=C1)C>C(Cl)(Cl)(Cl)[H].[O-2].[O-2].[Mn+4]>BrC1=C(C=C(C=O)C=C1)C
3
Br[C:2]1[CH:7]=[CH:6][CH:5]=[C:4]([CH3:8])[N:3]=1.O.[NH2:10][NH2:11]>>[CH3:8][C:4]1[N:3]=[C:2]([NH:10][NH2:11])[CH:7]=[CH:6][CH:5]=1
1
[Cl:1][C:2]1[N:7]=[CH:6][C:5]([S:8]([NH:11][C:12]2[C:21](Cl)=[N:20][C:19]3[C:14](=[CH:15][CH:16]=[CH:17][CH:18]=3)[N:13]=2)(=[O:10])=[O:9])=[CH:4][CH:3]=1.[CH3:23][O:24][C:25]1[CH:26]=[C:27]([CH:29]=[C:30]([O:32][CH3:33])[CH:31]=1)[NH2:28].C1(C)C=CC=CC=1>CCOCC>[Cl:1][C:2]1[N:7]=[CH:6][C:5]([S:8]([NH:11][C:12]2[C:21]([N...
1
FC1=CC=C(C=C1)NC(=O)C1=NNC2=CC=C(C=C12)[N+](=O)[O-]>>FC1=CC=C(C=C1)NC(=O)C1=NNC2=CC=C(C=C12)N
5
COC(CN1N=CC2=CC(=CC=C12)I)OC.FC(C1=CC=C(C=C1)C1=CC(NC=C1)=O)(F)F>[Cu]I.CS(=O)C.C(=O)([O-])[O-].[Cs+].[Cs+].OC=1C=CC=C2C=CC=NC12>COC(CN1N=CC2=CC(=CC=C12)N1C(C=C(C=C1)C1=CC=C(C=C1)C(F)(F)F)=O)OC
3
COC(CC1C(C1)C1=CC(=C(C=C1)OC)F)=O>ClCCl.B(Br)(Br)Br>COC(CC1C(C1)C1=CC(=C(C=C1)O)F)=O
3
[F:1][C:2]1[CH:7]=[CH:6][CH:5]=[C:4]([F:8])[C:3]=1[CH:9]([O:38][Si](C(C)(C)C)(C)C)[CH2:10][C:11]([C:14]1[N:15]=[C:16]([CH:19]2[CH2:24][CH2:23][N:22]([C:25](=[O:37])[CH2:26][N:27]3[C:31]([CH3:32])=[CH:30][C:29]([C:33]([F:36])([F:35])[F:34])=[N:28]3)[CH2:21][CH2:20]2)[S:17][CH:18]=1)=[N:12][OH:13].[F-].C([N+](CCCC)(CCCC)...
1
NC=1C=C(C=CC1)C(F)(F)F.C(CCC)N=C=S>>C(CCC)NC(=S)NC1=CC(=CC=C1)C(F)(F)F
5
[NH2:1][C:2]1[N:7]=[CH:6][N:5]=[C:4]2[N:8]([C@@H:25]3[CH2:30][CH2:29][CH2:28][N:27](C(OC(C)(C)C)=O)[CH2:26]3)[N:9]=[C:10]([C:11]3[CH:16]=[CH:15][C:14]([O:17][C:18]4[CH:23]=[CH:22][CH:21]=[CH:20][CH:19]=4)=[C:13]([Cl:24])[CH:12]=3)[C:3]=12.Cl.[Na+].C(=O)(O)[O-]>O1CCOCC1>[Cl:24][C:13]1[CH:12]=[C:11]([C:10]2[C:3]3[C:4](=[...
2
[Cl:1][C:2]1[C:3]([CH3:24])=[C:4]([CH2:8][NH:9][C:10]2[N:11]=[C:12]([N:18]3[CH2:23][CH2:22][O:21][CH2:20][CH2:19]3)[S:13][C:14]=2[C:15]([NH2:17])=[O:16])[CH:5]=[CH:6][CH:7]=1.[C:25](OCC(Cl)=O)(=[O:27])[CH3:26].[OH-].[Na+].Cl>COCCOC.CO>[Cl:1][C:2]1[C:3]([CH3:24])=[C:4]([CH2:8][N:9]2[C:10]3[N:11]=[C:12]([N:18]4[CH2:19][C...
1
[CH2:1]([O:3][C:4]([C:6]1[CH:7]=[C:8]2[N:13]([C:14]=1[C:15]1[CH:16]=[N:17][C:18]([CH3:21])=[CH:19][CH:20]=1)[CH:12]=[CH:11][C:10]([CH2:22][N:23]=[N+:24]=[N-:25])=[CH:9]2)=[O:5])[CH3:2].[CH2:26]([C:28]([O:35][C:36](=[O:46])[C:37]1[CH:42]=[CH:41][C:40]([N+:43]([O-:45])=[O:44])=[CH:39][CH:38]=1)([C:31]([F:34])([F:33])[F:3...
2
[Cl:1][C:2]1[C:3](=[O:34])[N:4]([CH2:19][CH2:20][C:21]2[CH:26]=[CH:25][C:24]([C:27]([N:29]3C=CN=C3)=[O:28])=[CH:23][CH:22]=2)[C:5]([CH2:9][O:10][C:11]2[CH:16]=[CH:15][CH:14]=[C:13](CC)[CH:12]=2)=[C:6]([Cl:8])[CH:7]=1.C1CCN2C(=NCCC2)CC1.[C:46]([O:49][CH2:50][CH2:51][CH2:52][S:53](N)(=[O:55])=[O:54])(=[O:48])[CH3:47].Cl....
2
P(Cl)(Cl)(Cl)(Cl)[Cl:2].O[CH2:8][S:9][C:10](=[O:17])[C:11]1[CH:16]=[CH:15][CH:14]=[CH:13][CH:12]=1>CCOCC>[Cl:2][CH2:8][S:9][C:10](=[O:17])[C:11]1[CH:16]=[CH:15][CH:14]=[CH:13][CH:12]=1
1
[Cl:1][C:2]1[CH:10]=[CH:9][CH:8]=[CH:7][C:3]=1[C:4]([OH:6])=O.[F:11][C:12]1([F:28])[CH2:17][CH2:16][CH:15]([CH:18]([C:21]2[CH:22]=[N:23][C:24]([CH3:27])=[N:25][CH:26]=2)[CH2:19][NH2:20])[CH2:14][CH2:13]1>>[Cl:1][C:2]1[CH:10]=[CH:9][CH:8]=[CH:7][C:3]=1[C:4]([NH:20][CH2:19][CH:18]([CH:15]1[CH2:16][CH2:17][C:12]([F:28])([...
1
FC=1C=CC=C2C(=CNC12)CCN1C(C2=CC=CC=C2C1=O)=O>>C(C(=O)O)(=O)O.FC1=C2NC=C(CCN)C2=CC=C1
5
COC(=O)[NH:4][C:5]1[CH:10]=[CH:9][C:8]([F:11])=[C:7]([C:12]([C:14]2[C:22]3[C:17](=[N:18][CH:19]=[CH:20][C:21]=3[C:23]#[N:24])[NH:16][CH:15]=2)=[O:13])[C:6]=1[F:25].I[Si](C)(C)C>C(#N)C>[NH2:4][C:5]1[C:6]([F:25])=[C:7]([C:8]([F:11])=[CH:9][CH:10]=1)[C:12]([C:14]1[C:22]2[C:21]([C:23]#[N:24])=[CH:20][CH:19]=[N:18][C:17]=2[...
2
C(C)(C)C1C(NCCN1)=O.CS(=O)(=O)OC[C@@H]1N(CCN(C1)S(=O)(=O)C=1SC=CC1)C1=CC=C(C=C1)C(C(F)(F)F)(C)O>>CC(C)C1C(NCCN1C[C@@H]1N(CCN(C1)S(=O)(=O)C=1SC=CC1)C1=CC=C(C=C1)C(C(F)(F)F)(C)O)=O
5
[NH2:1][CH2:2][CH2:3][C:4]1[C:12]2[C:7](=[CH:8][CH:9]=[CH:10][CH:11]=2)[NH:6][CH:5]=1.[CH2:13]([O:20][C:21](Cl)=[O:22])[C:14]1[CH:19]=[CH:18][CH:17]=[CH:16][CH:15]=1.C([O-])(O)=O.[Na+]>C(Cl)(Cl)Cl.O>[CH2:13]([O:20][C:21]([NH:1][CH2:2][CH2:3][C:4]1[C:12]2[C:7](=[CH:8][CH:9]=[CH:10][CH:11]=2)[NH:6][CH:5]=1)=[O:22])[C:14]...
1
[O:1]=[S:2]1(=[O:31])[CH2:7][CH:6]=[C:5]([C:8]2[CH:13]=[CH:12][C:11]([N:14]3[CH2:18][C@H:17]([CH2:19][N:20]4[CH:24]=[C:23]([CH:25]=[C:26](Br)[Br:27])[N:22]=[N:21]4)[O:16][C:15]3=[O:29])=[CH:10][C:9]=2[F:30])[CH2:4][CH2:3]1.C(OP([O-])OCC)C.C(N(CC)CC)C>C(O)C.ClCCl>[O:31]=[S:2]1(=[O:1])[CH2:3][CH:4]=[C:5]([C:8]2[CH:13]=[C...
1
ClC1=NC(=CC(=N1)Cl)Cl.NC1(CCN(CC1)CC1=CC=CC=C1)CO>C1CCCO1.[H-].[Na+]>C(C1=CC=CC=C1)N1CCC(CC1)(NC1=NC(=NC(=C1)Cl)Cl)CO
3
[CH2:1]([N:8]([CH2:21][C:22]1[CH:46]=[CH:45][C:25]([O:26][C:27]2[CH:44]=[CH:43][C:30]([O:31][CH2:32][CH2:33][CH2:34][C:35]([NH:37][CH2:38][C:39]([O:41]C)=[O:40])=[O:36])=[CH:29][CH:28]=2)=[CH:24][CH:23]=1)[C:9]1[CH:14]=[CH:13][CH:12]=[C:11]([NH:15][S:16]([CH3:19])(=[O:18])=[O:17])[C:10]=1[CH3:20])[C:2]1[CH:7]=[CH:6][CH...
1
[Br:1][C:2]1[C:10]([CH3:11])=[CH:9][C:5]([C:6](O)=[O:7])=[C:4]([F:12])[CH:3]=1.[CH3:13][S:14]([NH2:17])(=[O:16])=[O:15].Cl.C(N=C=NCCCN(C)C)C>CN(C)C1C=CN=CC=1.C(Cl)Cl>[Br:1][C:2]1[C:10]([CH3:11])=[CH:9][C:5]([C:6]([NH:17][S:14]([CH3:13])(=[O:16])=[O:15])=[O:7])=[C:4]([F:12])[CH:3]=1
2
[CH:1]#[C:2][CH2:3][OH:4].Cl.NO.[OH-].[K+].Cl[C:11]([CH2:14][C:15]([CH3:18])([CH3:17])[CH3:16])=[CH:12]C.[CH2:19](O)C>>[CH3:18][C:15]([CH3:16])([CH3:17])[CH2:14][C:11](=[CH2:12])[CH2:19][C:1]#[C:2][CH2:3][OH:4]
1
C([N:5]1[C:14]2[C:9](=CC=CC=2)[N:8]2[CH:15]=N[C:17]([C:18](OCC)=O)=[C:7]2[C:6]1=[O:23])(C)(C)C.[N+:24](CC(OCC)=O)#[C-].[C:32]([N:36]1[C:45]2[C:40](=[CH:41][CH:42]=[CH:43][CH:44]=2)[NH:39][C:38](=O)[C:37]1=[O:47])([CH3:35])([CH3:34])[CH3:33]>>[C:32]([N:36]1[C:45]2[C:40](=[CH:41][CH:42]=[CH:43][CH:44]=2)[N:39]2[CH:15]=[N...
1
[Cl:1][CH2:2][CH2:3][CH2:4][O:5][C:6]1[CH:11]=[CH:10][C:9]([C:12]2[CH:17]=[CH:16][N+:15]([O-:18])=[CH:14][CH:13]=2)=[CH:8][CH:7]=1.C(=O)([O-])[O-].[K+].[K+].C(O)(=O)C(C1C=CC=CC=1)O.[CH3:36][C@H:37]1[CH2:42][CH2:41][CH2:40][NH:39][CH2:38]1.Cl>CN(C)C=O.C(O)C.C(N(CC)CC)C>[ClH:1].[CH3:36][C@H:37]1[CH2:42][CH2:41][CH2:40][N...
1
[CH2:1]([C:4]1[CH:9]=[CH:8][CH:7]=[C:6]([N+:10]([O-:12])=[O:11])[C:5]=1[OH:13])[CH:2]=[CH2:3].[CH3:14][C:15]([CH3:17])=O.C(=O)([O-])[O-].[K+].[K+].ICC=C>C(OCC)(=O)C>[CH2:1]([C:4]1[CH:9]=[CH:8][CH:7]=[C:6]([N+:10]([O-:12])=[O:11])[C:5]=1[O:13][CH2:17][CH:15]=[CH2:14])[CH:2]=[CH2:3]
1
CC1=CC=C2C=C(C=NC2=C1)C=O>C1CCCO1.[BH4-].[Li+]>CC1=CC=C2C=C(C=NC2=C1)CO
3
[CH3:1][O:2][C:3]1[CH:8]=[CH:7][CH:6]=[CH:5][C:4]=1[OH:9].O1[CH2:15][CH2:14][O:13][CH2:12]C1.[OH-].[Na+].C(C1OC1)Cl>O.CCOCC>[CH3:1][O:2][C:3]1[CH:8]=[CH:7][CH:6]=[CH:5][C:4]=1[O:9][CH2:15][CH:14]1[O:13][CH2:12]1
1
[Mg].II.[C:4]1([CH2:10][CH2:11][CH2:12]Br)[CH:9]=[CH:8][CH:7]=[CH:6][CH:5]=1.[Br-].C([O:17][P:18](Cl)[O:19]CC)C.C([Mg]Br)CC1C=CC=CC=1.Cl>C(OCC)C.O>[C:4]1([CH2:10][CH2:11][CH2:12][PH:18](=[O:17])[OH:19])[CH:9]=[CH:8][CH:7]=[CH:6][CH:5]=1
1
C(C)(C)N1CC2=CC(=CC=C2CC1)[N+](=O)[O-]>CCO[H].[HH].[Pd]>C(C)(C)N1CC2=CC(=CC=C2CC1)N
3
[NH2:1][C@H:2]([C:10]([OH:12])=O)[CH2:3][C:4]1[CH:9]=[CH:8][CH:7]=[CH:6][CH:5]=1.[CH:13]([C:16]1[CH:22]=[CH:21][CH:20]=[C:19]([CH:23]([CH3:25])[CH3:24])[C:17]=1[NH2:18])([CH3:15])[CH3:14].C(N(CC)CC)C.[S:33](Cl)([C:36]1[CH:42]=[CH:41][C:39]([CH3:40])=[CH:38][CH:37]=1)(=[O:35])=[O:34]>ClCCl>[CH3:24][CH:23]([C:19]1[CH:20]...
1
ClC1=C(C(=NC(=N1)N)NC1CCOCC1)N>>NC1=NC(=C2NC(N(C2=N1)C1CCOCC1)=O)Cl
5
[CH2:1]([C:4]1[CH:12]=[CH:11][CH:10]=[CH:9][C:5]=1[C:6]([OH:8])=O)[CH:2]=[CH2:3].C(Cl)(=O)C(Cl)=O.C(Cl)Cl.[CH2:22]([O:25][C:26]1([CH3:55])[CH2:31][CH2:30][N:29]([C:32]2[N:37]3[N:38]=[C:39]([CH2:41][NH2:42])[CH:40]=[C:36]3[N:35]=[C:34]([CH3:43])[C:33]=2[C@H:44]([O:50][C:51]([CH3:54])([CH3:53])[CH3:52])[C:45]([O:47][CH2:...
1
C1(C2C=CC(CNCCC3C=CC(F)=C(C(F)(F)F)C=3)=CC=2)CC1.[CH3:25][C:26]([C:30]1[CH:37]=[CH:36][C:33]([CH:34]=O)=[CH:32][CH:31]=1)([CH3:29])[CH2:27][CH3:28].[Cl:38][C:39]1[CH:40]=[C:41]([CH2:46][CH2:47][NH2:48])[CH:42]=[CH:43][C:44]=1[Cl:45].[BH4-].[Na+]>>[Cl:38][C:39]1[CH:40]=[C:41]([CH2:46][CH2:47][NH:48][CH2:34][C:33]2[CH:36...
1
C1(CCCC1)OC=1C=C(C=CC1OC)C(O)C1=CC=CC=C1>ClCCl.[O-2].[O-2].[Mn+4]>C1(CCCC1)OC=1C=C(C=CC1OC)C(=O)C1=CC=CC=C1
3
C([O:5][C:6](=[O:34])[C:7]1[CH:12]=[CH:11][C:10]([CH2:13][N:14]2[C:23](=[O:24])[C:22]3[C:17](=[CH:18][CH:19]=[C:20]([C:25]#[C:26][CH2:27][N:28]4[CH2:33][CH2:32][O:31][CH2:30][CH2:29]4)[CH:21]=3)[N:16]=[CH:15]2)=[CH:9][CH:8]=1)(C)(C)C.[F:35][C:36]([F:41])([F:40])[C:37]([OH:39])=[O:38]>>[F:35][C:36]([F:41])([F:40])[C:37]...
1
C(C1=CC=CC=C1)Br.Br.C1(NC=CC2=CN=CC=C12)=O>CC#N.[Na+].[BH4-]>C(C1=CC=CC=C1)N1CC=2C=CNC(C2CC1)=O
3
[NH2:1][C:2]1[CH:7]=[CH:6][C:5]([NH:8][C:9]([NH:11][C:12]2[CH:17]=[CH:16][CH:15]=[CH:14][CH:13]=2)=[O:10])=[CH:4][CH:3]=1.N1C=CC=CC=1.[C:24]1([CH3:34])[CH:29]=[CH:28][C:27]([S:30](Cl)(=[O:32])=[O:31])=[CH:26][CH:25]=1>C(OCC)(=O)C>[CH3:34][C:24]1[CH:29]=[CH:28][C:27]([S:30]([NH:1][C:2]2[CH:3]=[CH:4][C:5]([NH:8][C:9]([NH...
2
COC1C=CC(C[N:8]2[C:12]3=[N:13][CH:14]=[CH:15][C:16]([O:17][C:18]4[CH:23]=[CH:22][C:21]([NH:24][C:25]([C:27]5[C:28](=[O:40])[N:29]([C:33]6[CH:38]=[CH:37][C:36]([F:39])=[CH:35][CH:34]=6)[N:30]=[CH:31][CH:32]=5)=[O:26])=[CH:20][C:19]=4[F:41])=[C:11]3[C:10]([N:42]3[CH2:47][CH2:46][CH:45]([N:48]([CH3:50])[CH3:49])[CH2:44][C...
1
C(C)OC(=O)C=1C(=NC(=NC1)SC)NCCC>ClC=1C=C(C(=O)OO)C=CC1.C(C)(C)N(C(C)C)CC.CN1C(CCC1)=O>NC1=NC=C(C(=N1)NCCC)C(=O)OCC
3
[CH2:1]([NH:8][C:9]([C:11]1[S:15][C:14]([C:16]2[CH:21]=[N:20][CH:19]=[C:18](/[CH:22]=[CH:23]/[C:24]3[CH:29]=[CH:28][C:27]([C:30]([F:33])([F:32])[F:31])=[CH:26][CH:25]=3)[N:17]=2)=[N:13][C:12]=1[CH3:34])=[O:10])[C:2]1[CH:7]=[CH:6][CH:5]=[CH:4][CH:3]=1>C(OCC)(=O)C.C(O)C.[OH-].[OH-].[Pd+2]>[CH2:1]([NH:8][C:9]([C:11]1[S:15...
1
Cl.Cl.[Cl:3][C:4]1[N:9]=[N:8][CH:7]=[C:6]([NH:10][C:11]([CH3:16])([CH3:15])[C:12]([OH:14])=O)[CH:5]=1.C1C=CC2N(O)N=NC=2C=1.C(Cl)CCl.Cl.[F:32][C:33]([F:37])([F:36])[CH2:34][NH2:35]>C(Cl)Cl>[Cl:3][C:4]1[N:9]=[N:8][CH:7]=[C:6]([NH:10][C:11]([CH3:16])([CH3:15])[C:12]([NH:35][CH2:34][C:33]([F:37])([F:36])[F:32])=[O:14])[CH:...
1
[H-].[Na+].[CH3:3][CH2:4][CH:5](P(OCC)(OCC)=O)[C:6]([O:8][CH2:9][CH3:10])=[O:7].[C:19]([N:26]1[CH2:31][CH2:30][C:29](=O)[CH2:28][CH2:27]1)([O:21][C:22]([CH3:25])([CH3:24])[CH3:23])=[O:20]>C1COCC1>[CH2:9]([O:8][C:6](=[O:7])[C:5](=[C:29]1[CH2:30][CH2:31][N:26]([C:19]([O:21][C:22]([CH3:25])([CH3:24])[CH3:23])=[O:20])[CH2:...
2
COC(C(CC(=C)C)C1=CC(=CC(=C1)OCC1=CC=CC=C1)OCC1=CC=CC=C1)=O>CO[H].[OH-].[Na+].[HH].[Pd]>COC(C(CC(C)C)C1=CC(=CC(=C1)O)O)=O
3
ClC1=CC=C(CC2=NC=C(C(=N2)OC2CCN(CC2)CC2=NC3=C(C=NC(=C3)C#N)N2C[C@H]2OCC2)F)C=C1>CO[H].C[O-].[Na+]>ClC1=CC=C(CC2=NC=C(C(=N2)OC2CCN(CC2)CC2=NC3=C(C=NC(=C3)C(OC)=N)N2C[C@H]2OCC2)F)C=C1
3
[CH3:1][O:2][C:3](=[O:16])[C:4]1[CH:9]=[C:8](I)[C:7]([C:11]([F:14])([F:13])[F:12])=[CH:6][C:5]=1[NH2:15].[CH3:17][N:18]1[CH:22]=[C:21](B2OC(C)(C)C(C)(C)O2)[CH:20]=[N:19]1.C([O-])([O-])=O.[K+].[K+].C1(P(C2C=CC=CC=2)C2C=CC=CC=2)C=CC=CC=1>O1CCOCC1>[CH3:1][O:2][C:3](=[O:16])[C:4]1[CH:9]=[C:8]([C:21]2[CH:20]=[N:19][N:18]([C...
1
[OH:1][C:2]1[CH:9]=[CH:8][CH:7]=[C:6]([O:10][CH3:11])[C:3]=1[CH:4]=O.[OH-].[K+].Cl[CH2:15][C:16](=[O:18])C.[CH3:19]O>>[CH3:19][O:1][C:2]1[C:3]2[CH:4]=[C:11]([C:16](=[O:18])[CH3:15])[O:10][C:6]=2[CH:7]=[CH:8][CH:9]=1
2
[Cl-].[NH4+].[Cl:3][C:4]1[CH:9]=[CH:8][C:7]([N+:10]([O-])=O)=[C:6]([O:13][C:14]2[CH:19]=[CH:18][C:17]([Cl:20])=[CH:16][C:15]=2[Cl:21])[CH:5]=1>C(O)C.O.[Fe]>[Cl:3][C:4]1[CH:9]=[CH:8][C:7]([NH2:10])=[C:6]([O:13][C:14]2[CH:19]=[CH:18][C:17]([Cl:20])=[CH:16][C:15]=2[Cl:21])[CH:5]=1
2
N1=CC(=CC=C1)B(O)O.[Si](C)(C)(C(C)(C)C)OC[C@]1(CC=2N(CCS1)C(=NN2)C2(CC2)C2=CC=C(C=C2)Cl)C>>[Si](C)(C)(C(C)(C)C)OC[C@]1(CC=2N(CCS1)C(=NN2)C2(CC2)C2=CC=C(C=C2)C=2C=NC=CC2)C
5
CS(=O)(=O)Cl.C(CC(C)C)O>>P(=O)(O)(O)O.CC(CCNN)C
5
C1COCCN1.BrC1=CC(=C(C=O)C=C1)Cl>C1CCCO1.C(C)(=O)O.C(C)(=O)O[BH-](OC(C)=O)OC(C)=O.[Na+]>BrC1=CC(=C(CN2CCOCC2)C=C1)Cl
3
[CH2:1]([Li])CCC.C(NC(C)C)(C)C.[F:13][C:14]1[C:22]([CH3:23])=[C:21]([F:24])[C:20]([F:25])=[CH:19][C:15]=1[C:16]([OH:18])=[O:17].CI>O1CCCC1.O.C(OCC)C.CCCCCC>[F:13][C:14]1[C:22]([CH3:23])=[C:21]([F:24])[C:20]([F:25])=[C:19]([CH3:1])[C:15]=1[C:16]([OH:18])=[O:17]
1
[Na].[CH:2]1([OH:7])[CH2:6][CH2:5][CH2:4][CH2:3]1.Cl[C:9]1[N:17]=[C:16]([NH:18][C:19]2[CH:20]=[C:21]([NH:25][S:26]([CH3:29])(=[O:28])=[O:27])[CH:22]=[CH:23][CH:24]=2)[N:15]=[C:14]2[C:10]=1[N:11]=[CH:12][NH:13]2>CC(O)=O>[CH:2]1([O:7][C:9]2[N:17]=[C:16]([NH:18][C:19]3[CH:20]=[C:21]([NH:25][S:26]([CH3:29])(=[O:27])=[O:28]...
2
C(C1=CC=CC=C1)Br.Br.Br.Br.C(C)C=1C(=CC(=C(C1)O)F)C1=CC=C2C(=NNC2=C1)C1=NC2=C(CCNCC2)N1>N(C)(C)C=O.C(C)(C)N(C(C)C)CC>C(C1=CC=CC=C1)N1CCC2=C(CC1)N=C(N2)C2=NNC1=CC(=CC=C21)C2=CC(=C(C=C2CC)O)F
3
[Br:1][C:2]1[CH:8]=[CH:7][C:5]([NH2:6])=[CH:4][CH:3]=1.C(N(CC)CC)C.[Br:16][CH2:17][CH2:18][CH2:19][CH2:20][C:21](Cl)=[O:22].C(=O)([O-])[O-].[Na+].[Na+]>ClCCl>[Br:16][CH2:17][CH2:18][CH2:19][CH2:20][C:21]([NH:6][C:5]1[CH:7]=[CH:8][C:2]([Br:1])=[CH:3][CH:4]=1)=[O:22]
2
N[C@@]1([C@@H]2[C@]([C@@H]2C[C@H]1OCC1=CC(=C(C=C1)Cl)Cl)(C(=O)N)F)C#N>O(O[H])[H].O.C([O-])([O-])=O.[K+].[K+].CS(=O)C>N[C@@]1([C@@H]2[C@]([C@@H]2C[C@H]1OCC1=CC(=C(C=C1)Cl)Cl)(C(=O)N)F)C(=O)N
3
Cl[C:2]1[CH:7]=[C:6]([CH2:8][C:9]2[CH:14]=[CH:13][CH:12]=[CH:11][CH:10]=2)[N:5]=[C:4]([S:15][CH3:16])[N:3]=1.[NH3:17]>C(O)(C)C>[CH3:16][S:15][C:4]1[N:3]=[C:2]([NH2:17])[CH:7]=[C:6]([CH2:8][C:9]2[CH:14]=[CH:13][CH:12]=[CH:11][CH:10]=2)[N:5]=1
2
C(CCC)(=O)O.ClC1=NC=C(C=N1)C(F)(F)F.N1=C(C=CC=2CCCNC12)CCCC[NH]>O.C1CCCO1.C(O)([O-])=O.[Na+]>FCCCN(CC[C@@H](C(=O)O)NC1=NC=C(C=N1)C(F)(F)F)CCCCC1=NC=2NCCCC2C=C1
3
BrC1=C(N)C=C(C=C1)[N+](=O)[O-]>>NC1=C(C#N)C=CC(=C1)[N+](=O)[O-]
5
C1(=CC=CC2=CC=CC=C12)S(=O)(=O)Cl.O.O.CC1=CC=C(C=C1)S(=O)[O-].[Na+]>O>C1(=CC=CC2=CC=CC=C12)C1=C(C=CC(=C1)C)S(S(=O)(=O)C1=C(C=C(C=C1)C)C1=CC=CC2=CC=CC=C12)(=O)=O
3
[O:1]1[CH:5]=[CH:4][CH:3]=[C:2]1[P:6]([O:11][CH2:12][CH3:13])(=[O:10])[O:7][CH2:8][CH3:9].C([N-]C(C)C)(C)C.[Li+].[CH2:22]([Sn:26](Cl)([CH2:31][CH2:32][CH2:33][CH3:34])[CH2:27][CH2:28][CH2:29][CH3:30])[CH2:23][CH2:24][CH3:25]>C1COCC1>[CH2:31]([Sn:26]([CH2:22][CH2:23][CH2:24][CH3:25])([CH2:27][CH2:28][CH2:29][CH3:30])[C:...
1
Cl[C:2]1[C:7]([NH:8][C:9]2[C:18]3[C:13](=[CH:14][C:15]([F:20])=[CH:16][C:17]=3[F:19])[N:12]=[C:11]([C:21]3[CH:26]=[CH:25][CH:24]=[CH:23][N:22]=3)[C:10]=2[CH3:27])=[CH:6][C:5]([N:28]2[CH2:33][CH2:32][O:31][CH2:30][CH2:29]2)=[CH:4][N:3]=1.[F:34][CH:35]([F:52])[O:36][C:37]1[CH:42]=[CH:41][C:40](B2OC(C)(C)C(C)(C)O2)=[CH:39...
1
C(C)C=1OC2=C(N1)C(=CC=C2)OC>>BrC1(C=CC=C2C1=NC(O2)CC)OC
5
[C:1]([C:3]1[CH:8]=[C:7]([N+:9]([O-])=O)[CH:6]=[CH:5][C:4]=1[NH:12][C:13](=[O:19])[O:14][C:15]([CH3:18])([CH3:17])[CH3:16])#[N:2].C([O-])=O.[NH4+]>C(O)C.[Pd]>[NH2:9][C:7]1[CH:6]=[CH:5][C:4]([NH:12][C:13](=[O:19])[O:14][C:15]([CH3:16])([CH3:17])[CH3:18])=[C:3]([C:1]#[N:2])[CH:8]=1
1
[OH:1][C:2]1[C:7]([C:8]([OH:10])=O)=[CH:6][N:5]=[C:4]([N:11]2[CH:15]=[CH:14][CH:13]=[N:12]2)[N:3]=1.CCN(CC)CC.CN(C(ON1N=NC2C=CC=NC1=2)=[N+](C)C)C.F[P-](F)(F)(F)(F)F.[NH2:47][CH:48]([C:63]1[CH:68]=[CH:67][CH:66]=[CH:65][CH:64]=1)[C:49]1[CH:54]=[CH:53][C:52]([P:55]([CH2:60][CH2:61][CH3:62])(=[O:59])[O:56][CH2:57][CH3:58]...
1
FC1=CC=C(C=O)C=C1.C(CC#N)#N.COC=1C=C(C=CC1OC)C1=NN(C(C1)=O)C1=CC=CC=C1>CCN(CC)CC.CCO[H]>NC1=C(C(C2=C(N(N=C2C2=CC(=C(C=C2)OC)OC)C2=CC=CC=C2)O1)C1=CC=C(C=C1)F)C#N
3
C(C)OC(C1=C(N=CC=C1)Cl)=O.C(C(O)C)(=O)OCC>[H-].[Na+].COCCOC>CC1C(C=2C(=NC=CC2)O1)=O
3
[OH:1][CH:2]([CH3:10])/[CH:3]=[CH:4]/[C:5]([O:7][CH2:8][CH3:9])=[O:6].[CH:11]1([N:17]=[C:18]=[O:19])[CH2:16][CH2:15][CH2:14][CH2:13][CH2:12]1>C1(C)C=CC=CC=1>[CH:11]1([NH:17][C:18]([O:1][CH:2]([CH3:10])/[CH:3]=[CH:4]/[C:5]([O:7][CH2:8][CH3:9])=[O:6])=[O:19])[CH2:16][CH2:15][CH2:14][CH2:13][CH2:12]1
1
[CH3:1][O:2][C:3]1[CH:8]=[CH:7][CH:6]=[CH:5][C:4]=1B(O)O.Br[C:13]1[S:17][C:16]([S:18]([NH2:21])(=[O:20])=[O:19])=[CH:15][CH:14]=1.C1(P(C2C=CC=CC=2)C2C=CC=CC=2)C=CC=CC=1.C([O-])([O-])=O.[Na+].[Na+]>C(OCC)(=O)C.C([O-])(=O)C.[Pd+2].C([O-])(=O)C.O.C(O)CC>[CH3:1][O:2][C:3]1[CH:8]=[CH:7][CH:6]=[CH:5][C:4]=1[C:13]1[S:17][C:16...
1
N[C:2]1[CH:3]=[C:4]2[C:17](=[CH:18][CH:19]=1)[CH2:16][C@:6]1([C:14]3[C:9](=[N:10][CH:11]=[CH:12][CH:13]=3)[NH:8][C:7]1=[O:15])[CH2:5]2.N([O-])=O.[Na+].[BrH:24]>O>[Br:24][C:2]1[CH:3]=[C:4]2[C:17](=[CH:18][CH:19]=1)[CH2:16][C@:6]1([C:14]3[C:9](=[N:10][CH:11]=[CH:12][CH:13]=3)[NH:8][C:7]1=[O:15])[CH2:5]2
1
CC(C)O.N.Cl.ClC(C=1C=C2C(=CC=3N(C2=CC1)N=NN3)CCC3=CC(=CC=C3)Cl)(C3=CN=CN3C)C3=CC=C(C=C3)Cl>C1CCCO1>ClC1=CC=C(C=C1)C(N)(C=1C=C2C(=CC=3N(C2=CC1)N=NN3)CCC3=CC(=CC=C3)Cl)C3=CN=CN3C
3
[N+](=O)([O-])C1=CC=C(C=C1)CC(=O)N1C(C2=CC(=C(C=C2CC1)OC)OC)C>CO[H].Cl.[HH].C(C)(=O)OCC.[Pd]>NC1=CC=C(C=C1)CC(=O)N1C(C2=CC(=C(C=C2CC1)OC)OC)C
3
Br[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][C:7]([NH:9][C:10]1[C:11]([S:21][CH:22]([CH3:24])[CH3:23])=[N:12][C:13]([CH3:20])=[CH:14][C:15]=1[S:16][CH:17]([CH3:19])[CH3:18])=[O:8].[SH:25][C:26]1[O:27][C:28]2[CH:34]=[CH:33][CH:32]=[CH:31][C:29]=2[N:30]=1.C(=O)([O-])[O-].[K+].[K+].C1OCCOCCOCCOCCOCCOC1>CN(C=O)C>[O:27]1[C:28]2[CH...
1
[F:1][C:2]1[CH:7]=[CH:6][C:5]([C:8]([F:11])([F:10])[F:9])=[CH:4][C:3]=1[OH:12].[Cl:13][C:14]1[CH:19]=[CH:18][C:17]([CH:20](O)[CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][N:26]2[CH2:31][CH2:30][CH:29]([C:32]3[CH:33]=[C:34]([NH:38][C:39](=[O:43])[CH:40]([CH3:42])[CH3:41])[CH:35]=[CH:36][CH:37]=3)[CH2:28][CH2:27]2)=[CH:16][CH...
1
[C:1]1([C:7]2[CH2:8][CH2:9][N:10]([CH2:13][CH2:14][CH2:15][N:16]3[CH:24]([OH:25])[C:23]4[C:18](=[CH:19][CH:20]=[CH:21][CH:22]=4)[C:17]3=[O:26])[CH2:11][CH:12]=2)[CH:6]=[CH:5][CH:4]=[CH:3][CH:2]=1.[H-].[Na+].[C:29](Cl)(=[O:33])[CH2:30][CH2:31][CH3:32].[C:35]([OH:40])(=[O:39])[C:36]([OH:38])=[O:37]>CN(C)C=O.C(#N)C>[C:35]...
1
CNC1=CC(=CC=C1)C1=NOC(C1)(C(F)(F)F)C1=CC(=CC(=C1)Cl)Cl>O.C1CCCO1.Cl.N(=O)[O-].[Na+]>CN(C1=CC(=CC=C1)C1=NOC(C1)(C(F)(F)F)C1=CC(=CC(=C1)Cl)Cl)N=O
3
F[P-](F)(F)(F)(F)F.N1(O[P+](N(C)C)(N(C)C)N(C)C)C2C=CC=CC=2N=N1.[N:28]1[CH:33]=[CH:32][CH:31]=[N:30][C:29]=1[N:34]1[CH:38]=[C:37]([NH2:39])[C:36]([C:40]([F:43])([F:42])[F:41])=[N:35]1.C1C=CC2N(O)N=NC=2C=1.[C:54]12([CH2:64][C:65](O)=[O:66])[CH2:63][CH:58]3[CH2:59][CH:60]([CH2:62][CH:56]([CH2:57]3)[CH2:55]1)[CH2:61]2.CCN(...
1
Cl.[F:2][C:3]1[CH:8]=[CH:7][C:6]([CH:9]([C:16]2[CH:21]=[CH:20][C:19]([F:22])=[CH:18][CH:17]=2)[CH:10]2[CH2:14][NH:13][CH2:12][C:11]2=[O:15])=[CH:5][CH:4]=1.C(NCC)(C)C.[CH3:29][O:30][C:31]1[CH:38]=[CH:37][CH:36]=[CH:35][C:32]=1[CH2:33]O>ClCCl>[F:2][C:3]1[CH:8]=[CH:7][C:6]([CH:9]([C:16]2[CH:17]=[CH:18][C:19]([F:22])=[CH:...
2
C1(=O)[N:5]([O:6][CH2:7][C@H:8]2[O:12][C@@H:11]([N:13]3[CH:21]=[C:19]([CH3:20])[C:17](=[O:18])[NH:16][C:14]3=[O:15])[CH2:10][C@@H:9]2[O:22][Si:23]([C:36]([CH3:39])([CH3:38])[CH3:37])([C:30]2[CH:35]=[CH:34][CH:33]=[CH:32][CH:31]=2)[C:24]2[CH:29]=[CH:28][CH:27]=[CH:26][CH:25]=2)C(=O)C2=CC=CC=C12.CNN>C(Cl)Cl>[NH2:5][O:6][...
1