smiles stringlengths 15 6.12k | source_id int64 1 5 |
|---|---|
[C:1]([C:3]1([NH:6][C:7]([C@@H:9]2[CH2:13][C@@H:12]([S:14][C:15]3[CH:20]=[CH:19][CH:18]=[CH:17][C:16]=3[O:21][CH3:22])[CH2:11][N:10]2C(OC(C)(C)C)=O)=[O:8])[CH2:5][CH2:4]1)#[N:2]>C(O)=O>[C:1]([C:3]1([NH:6][C:7]([C@@H:9]2[CH2:13][C@@H:12]([S:14][C:15]3[CH:20]=[CH:19][CH:18]=[CH:17][C:16]=3[O:21][CH3:22])[CH2:11][NH:10]2)=[O:8])[CH2:5][CH2:4]1)#[N:2] | 1 |
F[C:2]1[CH:7]=[CH:6][C:5]([C:8]2[O:9][C:10]3[CH:16]=[CH:15][CH:14]=[CH:13][C:11]=3[N:12]=2)=[CH:4][C:3]=1[N+:17]([O-])=O.C(=O)([O-])[O-].[K+].[K+].[CH3:26][O:27][CH2:28][CH2:29][NH2:30].[H][H]>C(O)C.[C].[Pd].O>[CH3:26][O:27][CH2:28][CH2:29][NH:30][C:2]1[CH:7]=[CH:6][C:5]([C:8]2[O:9][C:10]3[CH:16]=[CH:15][CH:14]=[CH:13][C:11]=3[N:12]=2)=[CH:4][C:3]=1[NH2:17] | 1 |
[CH3:1][O:2][CH2:3][CH2:4][O:5][C:6]([NH:8][C@H:9]1[CH2:14][CH2:13][CH2:12][CH2:11][C@@H:10]1[N:15]1[C:19]([C:20]2[CH:25]=[CH:24][CH:23]=[CH:22][CH:21]=2)=[C:18]([C:26]([O:28]CC)=[O:27])[N:17]=[CH:16]1)=[O:7].[OH-].[Na+].Cl>COC(O)C>[CH3:1][O:2][CH2:3][CH2:4][O:5][C:6]([NH:8][C@H:9]1[CH2:14][CH2:13][CH2:12][CH2:11][C@@H:10]1[N:15]1[C:19]([C:20]2[CH:25]=[CH:24][CH:23]=[CH:22][CH:21]=2)=[C:18]([C:26]([OH:28])=[O:27])[N:17]=[CH:16]1)=[O:7] | 2 |
ClC=1N=C(C(N(C1C1=C(C=C(C=C1F)OC)F)CC(CC)C)=O)N1N=CC=C1>ClCCl.B(Br)(Br)Br>ClC=1N=C(C(N(C1C1=C(C=C(C=C1F)O)F)CC(CC)C)=O)N1N=CC=C1 | 3 |
COC1=CC=C(CNC=2N=CC=C3C4=C(N(C(C23)=O)C)C=C(C=C4)OC[C@H](CC(C)C)NC(OC(C)(C)C)=O)C=C1>CC#N.O.ClCCl.C(=O)(C(F)(F)F)O>NC=1N=CC=C2C3=C(N(C(C12)=O)C)C=C(C=C3)OC[C@H](CC(C)C)N | 3 |
[S:1]1[C:5]2[CH:6]=[CH:7][CH:8]=[CH:9][C:4]=2[CH:3]=[C:2]1[S:10](Cl)(=[O:12])=[O:11].[NH2:14][C:15]1[CH:16]=[C:17]([CH:21]=[CH:22][CH:23]=1)[C:18]([OH:20])=[O:19]>>[S:1]1[C:5]2[CH:6]=[CH:7][CH:8]=[CH:9][C:4]=2[CH:3]=[C:2]1[S:10]([NH:14][C:15]1[CH:16]=[C:17]([CH:21]=[CH:22][CH:23]=1)[C:18]([OH:20])=[O:19])(=[O:12])=[O:11] | 1 |
C(C1=CC=CC=C1)OC1=NC=C(C(=C1)OCC)I.CN(CCOC1=C(C=C(C=N1)NC(CC1=C(C=C(C=C1)B1OC(C(O1)(C)C)(C)C)F)=O)C(F)(F)F)C>>C(C1=CC=CC=C1)OC1=CC(=C(C=N1)C1=CC(=C(C=C1)CC(=O)NC=1C=NC(=C(C1)C(F)(F)F)OCCN(C)C)F)OCC | 5 |
C1(=CC=CC=C1)C(C1=CC=CC=C1)N(C[C@H](C)N(C(OC(C)(C)C)=O)C)C>>Cl.Cl.CN(C[C@H](C)NC)C(C1=CC=CC=C1)C1=CC=CC=C1 | 5 |
CS(=O)(=O)CCOC1=CC=C(C(=O)OCC)C=C1>C([O-])([O-])=O.[K+].[K+].N1CCCCC1>N1(CCCCC1)CCOC1=CC=C(C(=O)OCC)C=C1 | 3 |
[CH2:1]([C:3]1[CH:8]=[C:7]([C:9]2[N:13]=[C:12]([C:14]3[CH:19]=[C:18]([CH3:20])[N:17]=[C:16]([N:21]([CH:23]([CH3:25])[CH3:24])[CH3:22])[CH:15]=3)[O:11][N:10]=2)[CH:6]=[C:5]([CH3:26])[C:4]=1[CH2:27][CH2:28][C:29]([OH:31])=O)[CH3:2].CCN(C(C)C)C(C)C.C1CN([P+](ON2N=NC3C=CC=CC2=3)(N2CCCC2)N2CCCC2)CC1.F[P-](F)(F)(F)(F)F.[C:74]([O:78][C:79](=[O:83])[CH2:80][CH2:81][NH2:82])([CH3:77])([CH3:76])[CH3:75]>CN(C=O)C>[C:74]([O:78][C:79](=[O:83])[CH2:80][CH2:81][NH:82][C:29](=[O:31])[CH2:28][CH2:27][C:4]1[C:5]([CH3:26])=[CH:6][C:7]([C:9]2[N:13]=[C:12]([C:14]3[CH:19]=[C:18]([CH3:20])[N:17]=[C:16]([N:21]([CH:23]([CH3:24])[CH3:25])[CH3:22])[CH:15]=3)[O:11][N:10]=2)=[CH:8][C:3]=1[CH2:1][CH3:2])([CH3:77])([CH3:76])[CH3:75] | 1 |
ClCC1OC1.C1(=CC=CC=C1)CC1(CCNCC1)O>O.C(C)OCC.ClCCl>C(C1=CC=CC=C1)C1(CCN(CC1)CC(CCl)O)O | 3 |
FC1=C(C=CC(=C1)F)C1=NC(=NC=C1)N1CCN(CC1)C(=O)OC(C)(C)C>Cl.C(C)(=O)OCC>FC1=C(C=CC(=C1)F)C1=NC(=NC=C1)N1CCNCC1 | 3 |
C(CCC)[B-](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1.[Li+].[Cl-].C[S+](NC1=CC=CC=C1)C>CC#N.O.CO[H]>C(CCC)[B-](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1.C[S+](NC1=CC=CC=C1)C | 3 |
S(Cl)([Cl:3])=O.Cl.[CH3:6][NH:7][CH:8]([CH:13]([C:20]1[CH:25]=[CH:24][CH:23]=[CH:22][CH:21]=1)[C:14]1[CH:19]=[CH:18][CH:17]=[CH:16][CH:15]=1)[CH2:9][C:10]([OH:12])=[O:11].[CH3:26]O>>[ClH:3].[CH3:26][O:11][C:10](=[O:12])[CH2:9][CH:8]([NH:7][CH3:6])[CH:13]([C:20]1[CH:21]=[CH:22][CH:23]=[CH:24][CH:25]=1)[C:14]1[CH:15]=[CH:16][CH:17]=[CH:18][CH:19]=1 | 1 |
NC1=NN(C=C1)CC(C)(O)C.BrC=1C(N(N=C(C1)Cl)C)=O>ClCCl.O1CCOCC1.[Pd].[Pd].O=C(\C=C\c1ccccc1)\C=C\c2ccccc2.O=C(\C=C\c1ccccc1)\C=C\c2ccccc2.O=C(\C=C\c1ccccc1)\C=C\c2ccccc2.C1(=CC=CC=C1)P(C1=CC=CC=2C(C3=CC=CC(=C3OC12)P(C1=CC=CC=C1)C1=CC=CC=C1)(C)C)C1=CC=CC=C1>ClC=1C=C(C(N(N1)C)=O)NC1=NN(C=C1)CC(C)(C)O | 3 |
C(\C=C\CC\C=C\CC\C=C\C(=O)OCC)(=O)OCC>CC(C)C[AlH]CC(C)C.ClCCl>C(\C=C\CC\C=C\CC\C=C\CO)O | 3 |
C(C)I.C(#N)C1CN(C1)C(=O)OC(C)(C)C>C1CCCO1.C[Si](C)(C)[N-][Si](C)(C)C.[Li+]>C(C)(C)(C)OC(=O)N1CC(C1)(CC)C#N | 3 |
[CH3:1][N:2]([CH2:4][C:5]1[C:26]([O:27][CH2:28][CH2:29][CH2:30][NH:31][C:32]2[CH:37]=[CH:36][CH:35]=[CH:34][N:33]=2)=[CH:25][C:8]2[CH2:9][C:10]3[CH:23]=[C:22]([F:24])[CH:21]=[CH:20][C:11]=3[CH:12]([CH2:14][C:15]([O:17]CC)=[O:16])[CH2:13][C:7]=2[CH:6]=1)[CH3:3].N1C=CC=CC=1NCCCOC1C=CC2C[C@H](CC(OCC)=O)C3C=CC=CC=3CC=2C=1>CC(O)=O>[CH3:1][N:2]([CH2:4][C:5]1[C:26]([O:27][CH2:28][CH2:29][CH2:30][NH:31][C:32]2[CH:37]=[CH:36][CH:35]=[CH:34][N:33]=2)=[CH:25][C:8]2[CH2:9][C:10]3[CH:23]=[C:22]([F:24])[CH:21]=[CH:20][C:11]=3[CH:12]([CH2:14][C:15]([OH:17])=[O:16])[CH2:13][C:7]=2[CH:6]=1)[CH3:3] | 1 |
N1N=CC=2C1=NC=CC2.ClCC(=O)N1CN(C(C1)=O)C1=C(C(=CC=C1)Cl)C>>ClC=1C(=C(C=CC1)N1CN(CC1=O)C(CN1N=C2N=CC=CC2=C1)=O)C | 5 |
C(C)(=O)OC1=C(C(=O)OCCl)C=CC=C1.[N+](=O)([O-])OCCCCCC(=O)O>N(C)(C)C=O.CCN(CC)CC>C(C)(=O)OC1=C(C(=O)OCOC(CCCCCO[N+](=O)[O-])=O)C=CC=C1 | 3 |
NC[C@H](CC1=CC(=C(C(=O)NCC(F)(F)F)C=C1)F)N(C)C>CC#N.O.C(C)(=O)OCC.C(C)(=O)O.C=O.C(#N)[BH3-].[Na+]>CN([C@@H](CC1=CC(=C(C(=O)NCC(F)(F)F)C=C1)F)CNC(=O)[C@H]1[C@](C1)(C1=CC=CC=C1)C)C | 3 |
C(OC(C)Cl)(SCC)=O.C(C(C)C)(=O)[O-].C(CCC)[N+](CCCC)(CCCC)CCCC>>C(OC(C)OC(C(C)C)=O)(SCC)=O | 5 |
[I:1][C:2]1[CH:3]=[C:4]([CH:8]=[CH:9][CH:10]=1)[C:5]([NH2:7])=[O:6].[CH3:11][C:12]([CH:15]=O)([CH3:14])[CH3:13].[NH:17]1[C:21]2[CH:22]=[CH:23][CH:24]=[CH:25][C:20]=2[N:19]=[N:18]1.C1(C)C=CC(S(O)(=O)=O)=CC=1>>[N:17]1([CH:15]([NH:7][C:5](=[O:6])[C:4]2[CH:8]=[CH:9][CH:10]=[C:2]([I:1])[CH:3]=2)[C:12]([CH3:13])([CH3:14])[CH3:11])[C:21]2[CH:22]=[CH:23][CH:24]=[CH:25][C:20]=2[N:19]=[N:18]1 | 1 |
BrC1=C(C(=C(N)C=C1)[N+](=O)[O-])F>CCO[H].O.O.[Sn](Cl)Cl>BrC=1C(=C(C(=CC1)N)N)F | 3 |
FC1=CC=C(CC2=CC(=NN2)C(=O)OCC)C=C1>>FC1=CC=C(CC2=CC(=NN2)C(=O)O)C=C1 | 5 |
BrC1=CC=C(C=C1)C1=CC=CC=C1.C1=CC=CC=2C3=CC=CC=C3NC12>C1(=CC=CC=C1)C.[Pd+2].[O-]C(=O)C.[O-]C(=O)C.[HH].CC(C)(C)[O-].[Na+].C1(=CC=C(C=C1)C)C.C2=C(C=CC=C2C)C.C3=CC=CC(=C3C)C.C1(=CC=CC=C1)P([C-]1C=CC=C1)C1=CC=CC=C1.[C-]1(C=CC=C1)P(C1=CC=CC=C1)C1=CC=CC=C1.[Fe+2]>C1(=CC=C(C=C1)N1C2=CC=CC=C2C=2C=CC=CC12)C1=CC=CC=C1 | 3 |
[CH:1]1([O:6][C:7]2[CH:8]=[C:9]([C:15]3([C:25]#[CH:26])[CH2:20][CH2:19][C:18]4([O:24][CH2:23][CH2:22][O:21]4)[CH2:17][CH2:16]3)[CH:10]=[CH:11][C:12]=2[O:13][CH3:14])[CH2:5][CH2:4][CH2:3][CH2:2]1.Br[C:28]1[CH:33]=[CH:32][CH:31]=[CH:30][N:29]=1.C1(P(C2C=CC=CC=2)C2C=CC=CC=2)C=CC=CC=1.O>N1CCCCC1.[Pd].C1(P(C2C=CC=CC=2)C2C=CC=CC=2)C=CC=CC=1.C1(P(C2C=CC=CC=2)C2C=CC=CC=2)C=CC=CC=1.C1(P(C2C=CC=CC=2)C2C=CC=CC=2)C=CC=CC=1.C1(P(C2C=CC=CC=2)C2C=CC=CC=2)C=CC=CC=1.[Cu]I>[CH:1]1([O:6][C:7]2[CH:8]=[C:9]([C:15]3([C:25]#[C:26][C:28]4[CH:33]=[CH:32][CH:31]=[CH:30][N:29]=4)[CH2:20][CH2:19][C:18]4([O:21][CH2:22][CH2:23][O:24]4)[CH2:17][CH2:16]3)[CH:10]=[CH:11][C:12]=2[O:13][CH3:14])[CH2:2][CH2:3][CH2:4][CH2:5]1 | 1 |
[CH3:1][C:2]([O:37]C(=O)C)([CH3:36])[C:3]([N:5]1[CH2:8][CH:7]([CH2:9][C:10]2[N:11]([CH3:35])[C:12]3[C:17]([N:18]=2)=[C:16]([N:19]2[CH2:24][CH2:23][O:22][CH2:21][CH2:20]2)[N:15]=[C:14]([N:25]2[C:29]4[CH:30]=[CH:31][CH:32]=[CH:33][C:28]=4[N:27]=[C:26]2[CH3:34])[N:13]=3)[CH2:6]1)=[O:4].[Li+].[OH-]>C1COCC1.CO>[OH:37][C:2]([CH3:36])([CH3:1])[C:3]([N:5]1[CH2:8][CH:7]([CH2:9][C:10]2[N:11]([CH3:35])[C:12]3[C:17]([N:18]=2)=[C:16]([N:19]2[CH2:24][CH2:23][O:22][CH2:21][CH2:20]2)[N:15]=[C:14]([N:25]2[C:29]4[CH:30]=[CH:31][CH:32]=[CH:33][C:28]=4[N:27]=[C:26]2[CH3:34])[N:13]=3)[CH2:6]1)=[O:4] | 1 |
[CH3:1][C@@:2]1([OH:23])[C@H:6]([OH:7])[C@@H:5]([CH2:8][OH:9])[O:4][C@H:3]1[N:10]1[C:14]2[N:15]=[CH:16][N:17]=[C:18]([NH2:19])[C:13]=2[C:12]([N+:20]([O-:22])=[O:21])=[CH:11]1.N1C=CC=CC=1.O(Cl)Cl.[O-:33][P:34]([O:37][P:38]([O-:41])([O-:40])=[O:39])(=[O:36])[O-:35].C([NH+](CCCC)CCCC)CCC.C([NH+](CCCC)CCCC)CCC.C([NH+](CCCC)CCCC)CCC.C([NH+](CCCC)CCCC)CCC.C[O:95][P:96](OC)(OC)=[O:97]>C1(C)C=CC=CC=1>[CH3:1][C@@:2]1([OH:23])[C@H:6]([OH:7])[C@@H:5]([CH2:8][O:9][P:96]([O:36][P:34]([O:37][P:38]([OH:41])([OH:40])=[O:39])([OH:35])=[O:33])([OH:97])=[O:95])[O:4][C@H:3]1[N:10]1[C:14]2[N:15]=[CH:16][N:17]=[C:18]([NH2:19])[C:13]=2[C:12]([N+:20]([O-:22])=[O:21])=[CH:11]1 | 1 |
OCCC1(CN(C1)C(=O)OC(C)(C)C)S.C(C)OP(C1=CC=CC=C1)(C1=CC=CC=C1)(C1=CC=CC=C1)OCC>C1(=CC=CC=C1)C.C(C)(=O)OCC>S1CCC12CN(C2)C(=O)OC(C)(C)C | 3 |
FCCO.ClC1=NC=C(C=N1)C#CC1=CC=C(C=C1)C(C(=O)NCC)C>>C(C)NC(C(C)C1=CC=C(C=C1)C#CC=1C=NC(=NC1)OCCF)=O | 5 |
Br[C:2]1[CH:7]=[CH:6][C:5]([C:8]2[N:12]([CH2:13][CH:14]([CH3:16])[CH3:15])[N:11]=[C:10]([C:17]([O:19][CH2:20][CH3:21])=[O:18])[CH:9]=2)=[CH:4][CH:3]=1.[CH3:22][S:23]([C:26]1[CH:27]=[C:28](B(O)O)[CH:29]=[CH:30][CH:31]=1)(=[O:25])=[O:24].C([O-])([O-])=O.[Na+].[Na+]>O1CCOCC1.O.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>[CH2:13]([N:12]1[C:8]([C:5]2[CH:6]=[CH:7][C:2]([C:30]3[CH:29]=[CH:28][CH:27]=[C:26]([S:23]([CH3:22])(=[O:25])=[O:24])[CH:31]=3)=[CH:3][CH:4]=2)=[CH:9][C:10]([C:17]([O:19][CH2:20][CH3:21])=[O:18])=[N:11]1)[CH:14]([CH3:16])[CH3:15] | 2 |
Cl[C@@H]1OC2=C([C@H]1Cl)C=CC(=C2)C(=O)OC>>ClC1=COC2=C1C=CC(=C2)C(=O)OCC | 5 |
C(C1=CC=CC=C1)Br.O[C@H]1[C@H](CCC1)N1C(C2=CC=CC=C2C1=O)=O>>C(C1=CC=CC=C1)O[C@H]1[C@H](CCC1)N1C(C2=CC=CC=C2C1=O)=O | 5 |
[Cl:1][C:2]1[CH:7]=[C:6]([Cl:8])[CH:5]=[CH:4][C:3]=1[NH:9][NH2:10].C(N(CC([O-])=O)CC(O)=O)CN(CC([O-])=O)CC(O)=O.[Na+].[Na+].Cl[C:34](=[CH2:37])[C:35]#[N:36].S(=O)(=O)(O)O>CO>[NH2:36][C:35]1[N:9]([C:3]2[CH:4]=[CH:5][C:6]([Cl:8])=[CH:7][C:2]=2[Cl:1])[N:10]=[CH:37][CH:34]=1 | 2 |
CN(C(OC(C)(C)C)=O)C1CCC2(CC(C2)=O)CC1>CCO[H].Cl.NO.C(C)(=O)[O-].[K+]>ON=C1CC2(C1)CCC(CC2)N(C(OC(C)(C)C)=O)C | 3 |
[Cl:1][C:2]1[CH:7]=[CH:6][C:5]([CH:8]2[CH2:13][CH2:12][CH2:11][N:10]([C:14]([C:16]3[CH:21]=[CH:20][N:19]=[C:18]([NH:22][CH3:23])[CH:17]=3)=[O:15])[CH2:9]2)=[CH:4][CH:3]=1.Cl.Cl[C:26]1C=CC(C2CCCNC2)=C(C)C=1.CNC1C=C(C=CN=1)C(O)=O>>[Cl:1][C:2]1[CH:7]=[CH:6][C:5]([CH:8]2[CH2:13][CH2:12][CH2:11][N:10]([C:14]([C:16]3[CH:21]=[CH:20][N:19]=[C:18]([NH:22][CH3:23])[CH:17]=3)=[O:15])[CH2:9]2)=[C:4]([CH3:26])[CH:3]=1 | 2 |
C(N1[C@H:12]([CH3:13])[C@H:11]([C:14]2[CH:19]=[CH:18][CH:17]=[CH:16][CH:15]=2)OC1=O)(=O)CCCCC.Cl.[CH2:22]([O:24][C:25](=[O:36])[C@H:26]([CH2:28][CH2:29][C:30]1[CH:35]=[CH:34][CH:33]=[CH:32][CH:31]=1)[NH2:27])[CH3:23].CN(C([O:44]N1N=NC2C=CC=NC1=2)=[N+](C)C)C.F[P-](F)(F)(F)(F)F.CN1CCOCC1>CN(C=O)C>[CH2:11]([C@H:14]([CH2:15][CH2:16][CH2:17][CH3:18])[C:19]([NH:27][C@@H:26]([CH2:28][CH2:29][C:30]1[CH:35]=[CH:34][CH:33]=[CH:32][CH:31]=1)[C:25]([O:24][CH2:22][CH3:23])=[O:36])=[O:44])[CH:12]=[CH2:13] | 1 |
[C:1]([O:5][C:6]([NH:8][C@@H:9]1[CH2:13][CH2:12][N:11]([C:14]([O:16][CH:17]2[CH:24]3[CH2:25][CH:20]4[CH2:21][CH:22]([CH2:26][CH:18]2[CH2:19]4)[CH2:23]3)=[O:15])[CH2:10]1)=[O:7])([CH3:4])([CH3:3])[CH3:2].[CH3:27]I.[H-].[Na+].Cl>C1COCC1>[C:1]([O:5][C:6]([N:8]([CH3:27])[CH:9]1[CH2:13][CH2:12][N:11]([C:14]([O:16][CH:17]2[CH:18]3[CH2:19][CH:20]4[CH2:21][CH:22]([CH2:23][CH:24]2[CH2:25]4)[CH2:26]3)=[O:15])[CH2:10]1)=[O:7])([CH3:4])([CH3:2])[CH3:3].[CH2:2]([O:5][C:6]([NH:8][C@@H:9]1[CH2:13][CH2:12][N:11]([C:14]([O:16][CH:17]2[CH:24]3[CH2:23][CH:22]4[CH2:21][CH:20]([CH2:19][CH:18]2[CH2:26]4)[CH2:25]3)=[O:15])[CH2:10]1)=[O:7])[CH:1]([CH3:4])[CH3:3] | 1 |
[F:1][C:2]1[C:3]([CH3:11])=[C:4]([CH:8]=[CH:9][CH:10]=1)[C:5]([OH:7])=O.[F:12][C:13]1([F:31])[CH2:18][CH2:17][C:16]([CH2:29][NH2:30])([C:19]2[CH:20]=[N:21][C:22]([C:25]([F:28])([F:27])[F:26])=[CH:23][CH:24]=2)[CH2:15][CH2:14]1>>[F:31][C:13]1([F:12])[CH2:14][CH2:15][C:16]([CH2:29][NH:30][C:5](=[O:7])[C:4]2[CH:8]=[CH:9][CH:10]=[C:2]([F:1])[C:3]=2[CH3:11])([C:19]2[CH:20]=[N:21][C:22]([C:25]([F:26])([F:27])[F:28])=[CH:23][CH:24]=2)[CH2:17][CH2:18]1 | 1 |
C(C1=CC=CC=C1)O.ClC1=CC(=C(N)C=C1Cl)[N+](=O)[O-]>C(C)(=O)OCC.CN(C(C)=O)C.C(=O)([O-])[O-].[Cs+].[Cs+]>C(C1=CC=CC=C1)OC=1C(=CC(=C(C1)N)[N+](=O)[O-])Cl | 3 |
FC=1C=C(C2=C(C=CC(O2)(C)C)C1)[N+](=O)[O-]>CC#N.O(O[H])[H].ClCCl.[Ti].CC(C)(C)C1=CC(=CNCCCNC=C2C=C(C=C(C2=O)C(C)(C)C)C(C)(C)C)C(=O)C(=C1)C(C)(C)C>O1[C@H]2C(OC3=C([C@H]21)C=C(C=C3[N+](=O)[O-])F)(C)C | 3 |
CON(C(CC)=O)C.FC(C1=CC=C(OC2OCCCC2)C=C1)(F)F>C(CCC)[Li].CN(CCN(C)C)C>O1C(CCCC1)OC1=C(C=C(C=C1)C(F)(F)F)C(CC)=O | 3 |
[Al+3].[Cl-].[Cl-].[Cl-].[CH:5]([C:8]1[CH:16]=[C:15]2[C:11]([CH2:12][CH:13]([CH3:18])[C:14]2=[O:17])=[CH:10][C:9]=1[O:19][C:20]1[C:25]([F:26])=[C:24]([F:27])[C:23]([F:28])=[C:22]([F:29])[C:21]=1[F:30])([CH3:7])[CH3:6].[Br:31]Br>ClCCl.[O-]S([O-])=O.[Na+].[Na+]>[Br:31][C:10]1[C:9]([O:19][C:20]2[C:21]([F:30])=[C:22]([F:29])[C:23]([F:28])=[C:24]([F:27])[C:25]=2[F:26])=[C:8]([CH:5]([CH3:6])[CH3:7])[CH:16]=[C:15]2[C:11]=1[CH2:12][CH:13]([CH3:18])[C:14]2=[O:17] | 1 |
[Cl:1][C:2]1[CH:3]=[CH:4][CH:5]=[C:6]2[C:22]=1[C:9]1([CH:14]=[CH:13][N:12]([C:15]([O:17][C:18]([CH3:21])([CH3:20])[CH3:19])=[O:16])[CH2:11][CH2:10]1)[N:8]([CH2:23][C:24]1[CH:29]=[CH:28][C:27]([O:30][CH3:31])=[CH:26][CH:25]=1)[C:7]2=[O:32].Cl.CC(OC(OC(OC(C)(C)C)=O)=O)(C)C>O=[Pt]=O.CC#N>[Cl:1][C:2]1[CH:3]=[CH:4][CH:5]=[C:6]2[C:22]=1[C:9]1([CH2:14][CH2:13][N:12]([C:15]([O:17][C:18]([CH3:21])([CH3:20])[CH3:19])=[O:16])[CH2:11][CH2:10]1)[N:8]([CH2:23][C:24]1[CH:29]=[CH:28][C:27]([O:30][CH3:31])=[CH:26][CH:25]=1)[C:7]2=[O:32] | 1 |
ClCCO.N1C(=O)NC(=O)C1>N(C)(C)C=O.C([O-])([O-])=O.[K+].[K+]>OCCN1C(NCC1=O)=O | 3 |
[Cl:1][C:2]1[S:6][C:5]([NH:7][C:8](=[O:29])[N:9]([CH2:14][CH2:15][CH:16]([C:23]2[CH:28]=[CH:27][CH:26]=[CH:25][CH:24]=2)[C:17]2[CH:22]=[CH:21][CH:20]=[CH:19][CH:18]=2)[CH2:10][CH2:11]SC)=[N:4][C:3]=1[C:30]1[CH:35]=[CH:34][C:33]([NH:36][S:37]([CH3:40])(=[O:39])=[O:38])=[CH:32][CH:31]=1.OO[S:43]([O-:45])=[O:44].[K+].[CH3:47]O>O.C(Cl)Cl>[ClH:1].[Cl:1][C:2]1[S:6][C:5]([NH:7][C:8](=[O:29])[N:9]([CH2:14][CH2:15][CH:16]([C:23]2[CH:28]=[CH:27][CH:26]=[CH:25][CH:24]=2)[C:17]2[CH:18]=[CH:19][CH:20]=[CH:21][CH:22]=2)[CH2:10][CH2:11][S:43]([CH3:47])(=[O:45])=[O:44])=[N:4][C:3]=1[C:30]1[CH:35]=[CH:34][C:33]([NH:36][S:37]([CH3:40])(=[O:38])=[O:39])=[CH:32][CH:31]=1 | 2 |
C(=O)(OC(C)(C)C)OC(=O)OC(C)(C)C.BrC=1C(=NC=CC1)OC1=CC=C(C=C1)NC=1SC2=C(N1)C=CC=C2>>S1C(=NC2=C1C=CC=C2)N(C(OCCCC)=O)C2=CC=C(C=C2)OC2=NC=CC=C2Br | 5 |
ClC(=O)OCC.COC=1C=C(CCN)C=CC1>ClCCl.CCN(CC)CC>COC=1C=C(CCNC(OCC)=O)C=CC1 | 3 |
O1C2CC3=CC=CC=C3CC21>>N(=[N+]=[N-])[C@H]1[C@@H](CC2=CC=CC=C2C1)O | 5 |
[F:1][C:2]1([F:36])[CH2:7][CH2:6][N:5]([C:8]2[O:9][C:10]([C@@H:27]3[CH2:32][CH2:31][CH2:30][CH2:29][C@H:28]3[C:33](O)=[O:34])=[C:11]([C:13]3[CH:18]=[CH:17][C:16]([N:19]4[CH2:24][CH2:23][S:22](=[O:26])(=[O:25])[CH2:21][CH2:20]4)=[CH:15][CH:14]=3)[N:12]=2)[CH2:4][CH2:3]1.BrC1C=CC(C2N=C(C3C=CC(F)=C(F)C=3)OC=2[C@@H]2CCCC[C@H]2C([NH:57][C:58]2([C:61]#[N:62])[CH2:60][CH2:59]2)=O)=CC=1>>[C:61]([C:58]1([NH:57][C:33]([C@@H:28]2[CH2:29][CH2:30][CH2:31][CH2:32][C@H:27]2[C:10]2[O:9][C:8]([N:5]3[CH2:4][CH2:3][C:2]([F:1])([F:36])[CH2:7][CH2:6]3)=[N:12][C:11]=2[C:13]2[CH:14]=[CH:15][C:16]([N:19]3[CH2:24][CH2:23][S:22](=[O:25])(=[O:26])[CH2:21][CH2:20]3)=[CH:17][CH:18]=2)=[O:34])[CH2:60][CH2:59]1)#[N:62] | 2 |
CC1(OB(OC1(C)C)/C=C/C(=O)OCC)C.BrC=1C=C(C=CC1Cl)CN(C)C>O.C(C)(=O)OCC.O1CCOCC1.c1ccc(cc1)[P](c2ccccc2)(c3ccccc3)[Pd]([P](c4ccccc4)(c5ccccc5)c6ccccc6)([P](c7ccccc7)(c8ccccc8)c9ccccc9)[P](c1ccccc1)(c1ccccc1)c1ccccc1.C(=O)([O-])[O-].[Cs+].[Cs+]>ClC1=C(C=C(C=C1)CN(C)C)/C=C/C(=O)OCC | 3 |
[CH3:1][O:2][C:3]1[C:10]([O:11][CH3:12])=[CH:9][CH:8]=[CH:7][C:4]=1[CH:5]=O.[S:13]1[CH2:19][C:17](=[O:18])[NH:16][C:14]1=[S:15].C([O-])(=O)C.[Na+].C(O)(=O)C>O>[CH3:1][O:2][C:3]1[C:10]([O:11][CH3:12])=[CH:9][CH:8]=[CH:7][C:4]=1[CH:5]=[C:19]1[S:13][C:14](=[S:15])[NH:16][C:17]1=[O:18] | 1 |
C(N(CC)CC)C.[CH2:8]1[C:16]2[C:11](=[CH:12][CH:13]=[CH:14][CH:15]=2)[CH:10]=[CH:9]1.I[C:18]1[CH:23]=[CH:22][CH:21]=[CH:20][CH:19]=1>CC([O-])=O.CC([O-])=O.[Pd+2].C(O)C>[C:18]1([C:9]2[CH2:10][C:11]3[C:16]([CH:8]=2)=[CH:15][CH:14]=[CH:13][CH:12]=3)[CH:23]=[CH:22][CH:21]=[CH:20][CH:19]=1 | 1 |
C(C)=O.NCCCCNC(OC(C)(C)C)=O>O.CO[H].[Na+].[BH4-].C([O-])([O-])=O.[K+].[K+]>C(C)(C)(C)OC(NCCCCNCC)=O | 3 |
[N+](=O)([O-])C=1C=C(C(=CC1)CC(=O)O)CC(=O)O>>[N+](=O)([O-])C1=CC(=C(C=C1)CCO)CCO | 5 |
[Cl:1][C:2]1[CH:7]=[CH:6][C:5]([CH2:8][NH:9]C(=O)C(F)(F)F)=[CH:4][C:3]=1[C:16]1[NH:20][C:19](=[O:21])[N:18]([C:22]2[CH:40]=[CH:39][C:25]([C:26]([NH:28][C:29]3[CH:34]=[CH:33][C:32]([F:35])=[C:31]([CH:36]([F:38])[F:37])[CH:30]=3)=[O:27])=[C:24]([O:41][CH3:42])[CH:23]=2)[N:17]=1>[OH-].[K+].N>[NH2:9][CH2:8][C:5]1[CH:6]=[CH:7][C:2]([Cl:1])=[C:3]([C:16]2[NH:20][C:19](=[O:21])[N:18]([C:22]3[CH:40]=[CH:39][C:25]([C:26]([NH:28][C:29]4[CH:34]=[CH:33][C:32]([F:35])=[C:31]([CH:36]([F:38])[F:37])[CH:30]=4)=[O:27])=[C:24]([O:41][CH3:42])[CH:23]=3)[N:17]=2)[CH:4]=1 | 1 |
ClC1=CC(=C(C=C1)N\N=C(\C(=O)OCC)/C=N/O)F>>ClC1=CC(=C(C=C1)N1N=CC(=N1)C(=O)OCC)F | 5 |
O[C@@]1([C@@H](CCCC1)C)C(C(=O)O)=O.N1[C@@H](CCCC1)C(=O)OCCOC1=CC(=C(C=C1)OC)OC>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>O[C@@]1([C@@H](CCCC1)C)C(C(=O)N1C(CCCC1)C(=O)OCCOC1=CC(=C(C=C1)OC)OC)=O | 3 |
N1=C(C=CC=C1)C1=NOC(=N1)C1=CC(=CC(=C1)O)C#N>ClCCl.CCN(CC)CC.FC(S(=O)(=O)OS(=O)(=O)C(F)(F)F)(F)F>N1=C(C=CC=C1)C1=NOC(=N1)C1=CC(=CC(=C1)OS(=O)(=O)C(F)(F)F)C#N | 3 |
FC1=CC=C(C=C1)C(CC1=NC(=NC=C1)SC)=O>>CN(\C=C(/C(=O)C1=CC=C(C=C1)F)\C1=NC(=NC=C1)SC)C | 5 |
[F:1][C:2]1[CH:7]=[C:6](/[N:8]=[CH:9]/[C:10]2[O:11][C:12]([N+:15]([O-:17])=[O:16])=[CH:13][CH:14]=2)[CH:5]=[CH:4][C:3]=1[N:18]1[CH2:23][CH2:22][CH:21]([C:24]2[O:28][C:27](=[O:29])[NH:26][N:25]=2)[CH2:20][CH2:19]1.C([BH3-])#N.[Na+].C(=O)(O)[O-].[Na+]>CC(O)=O.CO>[F:1][C:2]1[CH:7]=[C:6]([NH:8][CH2:9][C:10]2[O:11][C:12]([N+:15]([O-:17])=[O:16])=[CH:13][CH:14]=2)[CH:5]=[CH:4][C:3]=1[N:18]1[CH2:19][CH2:20][CH:21]([C:24]2[O:28][C:27](=[O:29])[NH:26][N:25]=2)[CH2:22][CH2:23]1 | 1 |
N(C(OCC)=O)=NC(OCC)=O.Cl[C:14]1[C:23]2[C:18](=[CH:19][C:20](OC)=[C:21](O)[CH:22]=2)[N:17]=[CH:16][N:15]=1.C1(P(C2C=CC=CC=2)C2C=CC=CC=2)C=CC=CC=1.C(OC(N1CCCC(O)C1)=O)(C)(C)C>ClCCl>[N:17]1[C:18]2[C:23](=[CH:22][CH:21]=[CH:20][CH:19]=2)[CH:14]=[N:15][CH:16]=1 | 2 |
C(C)(C)(C)C=1C=C(C=C(C1O[Si](C)(C)C)C(C)(C)C)P(C1=CC=CC=C1)C1=CC(=C(C(=C1)C(C)(C)C)O[Si](C)(C)C)C(C)(C)C>O.CO[H]>C(C)(C)(C)C=1C=C(C=C(C1O)C(C)(C)C)P(C1=CC=CC=C1)C1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C | 3 |
ICCC.OC1=CC=C(C=C1)C1C(CN(CC1)C(=O)OCC1=CC=CC=C1)OCC=1C=CC2=C(N(CCO2)CCCOC)C1>>COCCCN1CCOC2=C1C=C(C=C2)COC2CN(CCC2C2=CC=C(C=C2)OCCC)C(=O)OCC2=CC=CC=C2 | 3 |
ClCC(=O)Cl.C(CCC)[C@H]1CC2=C(NC3=CC=CC=C23)[C@@H](N1)C1=C(C=C(C=C1)S(=O)(=O)NC1CC1)F>C(Cl)(Cl)(Cl)[H].CCCCCC.C(O)([O-])=O.[Na+]>C(CCC)[C@H]1CC2=C(NC3=CC=CC=C23)[C@@H](N1C(CCl)=O)C1=C(C=C(C=C1)S(=O)(=O)NC1CC1)F | 3 |
[CH3:1][S:2][C:3]1[N:8]=[C:7]([O:9][C:10]2[CH:15]=[CH:14][C:13]([N+:16]([O-])=O)=[C:12]([Cl:19])[CH:11]=2)[CH:6]=[CH:5][N:4]=1.C(O)C.[H][H]>[Pd].[O-]S([O-])(=O)=O.[Ba+2].C1COCC1>[Cl:19][C:12]1[CH:11]=[C:10]([O:9][C:7]2[CH:6]=[CH:5][N:4]=[C:3]([S:2][CH3:1])[N:8]=2)[CH:15]=[CH:14][C:13]=1[NH2:16] | 1 |
BrCC(C)C.C(C)OC(=O)C=1N(C(=C(C1C1=CC=C(C=C1)C1=NN=NN1)C#N)CC)C>N(C)(C)C=O.[H-].[Na+]>C(C)OC(=O)C=1N(C(=C(C1C1=CC=C(C=C1)C1=NN=NN1CC(C)C)C#N)CC)C | 3 |
C[C@@H]1NCCC1.ClCCCC(=O)NC=1C=C(C(=NC1)C)NC(=O)C=1C=NN2C1SC(=C2)C=2C=NN(C2)C>>CN1N=CC(=C1)C1=CN2C(S1)=C(C=N2)C(=O)NC=2C(=NC=C(C2)NC(CCCN2[C@H](CCC2)C)=O)C | 3 |
[F:1][C:2]1[CH:19]=[CH:18][C:5]([CH2:6][N:7]2[CH2:12][CH2:11][CH:10]([CH2:13][N+:14]([O-])=O)[CH2:9][C:8]2=[O:17])=[CH:4][CH:3]=1>C(O)C.[Ni].O>[NH2:14][CH2:13][CH:10]1[CH2:11][CH2:12][N:7]([CH2:6][C:5]2[CH:4]=[CH:3][C:2]([F:1])=[CH:19][CH:18]=2)[C:8](=[O:17])[CH2:9]1 | 1 |
FC1=C(C=CC(=C1)F)CCC(=O)O.NC=1SC=C(N1)C1=CC=C(C=C1)Cl>N(C)(C)C=O.ClCCl.c1ccncc1.C(C(=O)Cl)(=O)Cl>ClC1=CC=C(C=C1)C=1N=C(SC1)NC(CCC1=C(C=C(C=C1)F)F)=O | 3 |
C1(=CC=CC=C1)S(=O)(=O)Cl.IC1=CNC2=NC(=CC=C21)N2CCOCC2>C1CCCO1.CC(C)(C)[O-].[Na+]>IC1=CN(C2=NC(=CC=C21)N2CCOCC2)S(=O)(=O)C2=CC=CC=C2 | 3 |
BrCC1=CC=C(C#N)C=C1.[N+](=O)([O-])C=1N=C2OCC(CN2C1)O>>[N+](=O)([O-])C=1N=C2OCC(CN2C1)OCC1=CC=C(C#N)C=C1 | 5 |
CC(C(=O)O)(C)C.C([O-])([O-])=O.[Zn+2]>O>C(C(C)(C)C)(=O)[O-].[Zn+2].C(C(C)(C)C)(=O)[O-] | 3 |
C[O:2][C:3](=[O:41])[C:4]1[CH:9]=[CH:8][C:7]([NH:10][C:11]([N:13]2[CH2:17][C@@H:16]([CH2:18][C:19]([CH3:22])([CH3:21])[CH3:20])[C@@:15]([C:25]3[CH:30]=[CH:29][C:28]([Cl:31])=[CH:27][C:26]=3[F:32])([C:23]#[N:24])[C@H:14]2[C:33]2[CH:38]=[CH:37][CH:36]=[C:35]([Cl:39])[C:34]=2[F:40])=[O:12])=[CH:6][CH:5]=1.[Li+].[OH-]>C1COCC1.CO>[Cl:39][C:35]1[C:34]([F:40])=[C:33]([C@@H:14]2[C@:15]([C:25]3[CH:30]=[CH:29][C:28]([Cl:31])=[CH:27][C:26]=3[F:32])([C:23]#[N:24])[C@H:16]([CH2:18][C:19]([CH3:22])([CH3:21])[CH3:20])[CH2:17][N:13]2[C:11]([NH:10][C:7]2[CH:6]=[CH:5][C:4]([C:3]([OH:41])=[O:2])=[CH:9][CH:8]=2)=[O:12])[CH:38]=[CH:37][CH:36]=1 | 1 |
S1CNC(C2=C1C=CS2)=O>CC#N.COC=1C=CC(=CC1)P2(=S)SP(=S)(S2)C=3C=CC(=CC3)OC>S1CNC(C2=C1C=CS2)=S | 3 |
CO[C@@H](C(=O)O)C.COC1=CC=C(C=N1)C1=CC=C2C=NC(=NN21)NC2=CC(=CC=C2)N>>CO[C@@H](C(=O)NC1=CC(=CC=C1)NC1=NN2C(C=N1)=CC=C2C=2C=NC(=CC2)OC)C | 5 |
S(=O)(=O)(OC)OC.[K].OC1=C(C=O)C(=CC=C1OC)[N+](=O)[O-]>N(C)(C)C=O.C([O-])([O-])=O.[K+].[K+]>COC1=C(C=O)C(=CC=C1OC)[N+](=O)[O-] | 3 |
C(OC([N:8]1[C@H:13]([C:14](=[O:28])[NH:15][C:16]2[CH:21]=[CH:20][CH:19]=[C:18]([O:22][C:23]([F:26])([F:25])[F:24])[C:17]=2[F:27])[CH2:12][C@@H:11]2[C@H:9]1[CH2:10]2)=O)(C)(C)C.[C:29]([OH:35])([C:31]([F:34])([F:33])[F:32])=[O:30]>C(Cl)Cl>[F:32][C:31]([F:34])([F:33])[C:29]([OH:35])=[O:30].[F:27][C:17]1[C:18]([O:22][C:23]([F:26])([F:24])[F:25])=[CH:19][CH:20]=[CH:21][C:16]=1[NH:15][C:14]([C@@H:13]1[CH2:12][C@@H:11]2[C@@H:9]([CH2:10]2)[NH:8]1)=[O:28] | 1 |
C1(OCCO1)=O.FC=1C=C(C=CC1)SC=1C=C(C=CC1O)C1=CC=CC=C1>N(C)(C)C=O.C([O-])([O-])=O.[K+].[K+]>FC=1C=C(C=CC1)SC=1C=C(C=CC1OCCO)C1=CC=CC=C1 | 3 |
Cl[CH2:2][CH2:3][S:4](Cl)(=[O:6])=[O:5].[NH2:8][CH2:9][C@H:10]1[O:16][CH2:15][CH2:14][N:13]([C:17]([O:19][C:20]([CH3:23])([CH3:22])[CH3:21])=[O:18])[CH2:12][C@H:11]1[C:24]1[CH:29]=[CH:28][C:27]([Cl:30])=[C:26]([Cl:31])[CH:25]=1.C(N(CC)CC)C.O>C1COCC1>[Cl:31][C:26]1[CH:25]=[C:24]([C@H:11]2[C@@H:10]([CH2:9][NH:8][S:4]([CH:3]=[CH2:2])(=[O:6])=[O:5])[O:16][CH2:15][CH2:14][N:13]([C:17]([O:19][C:20]([CH3:23])([CH3:22])[CH3:21])=[O:18])[CH2:12]2)[CH:29]=[CH:28][C:27]=1[Cl:30] | 1 |
C(C)(=O)OC(C)=O.C1(CCCC1)NC=1C=NOC1C>C(C)(=O)O>C1(CCCC1)N(C(C)=O)C=1C=NOC1C | 3 |
FC1=CC=C(C=O)C=C1.BrC=1C=C(C(=O)NC)C=CC1>>OC(C1=CC=C(C=C1)F)C=1C=C(C(=O)NC)C=CC1 | 5 |
Cl.[NH2:2]O.[NH2:4][C:5]1[S:6][C:7]([CH:10]=O)=[CH:8][N:9]=1.[CH:12]([O-:14])=O.[Na+].C(O)=O>CO.C(Cl)(Cl)Cl>[C:10]([C:7]1[S:6][C:5]([NH:4][CH:12]=[O:14])=[N:9][CH:8]=1)#[N:2] | 1 |
CO.[C:3]([O:7][C:8]([NH:10][CH2:11][CH2:12][NH:13][C:14]1[C:24]([Cl:25])=[CH:23][C:17]([C:18](OCC)=[O:19])=[CH:16][N:15]=1)=[O:9])([CH3:6])([CH3:5])[CH3:4].[BH4-].[Na+]>C1COCC1>[Cl:25][C:24]1[C:14]([NH:13][CH2:12][CH2:11][NH:10][C:8](=[O:9])[O:7][C:3]([CH3:5])([CH3:4])[CH3:6])=[N:15][CH:16]=[C:17]([CH2:18][OH:19])[CH:23]=1 | 2 |
[C:1]([O:5][C:6]([NH:8][C:9]1[N:10]=[CH:11][C:12]([CH2:15][NH:16][C:17]2[CH:18]=[C:19]([CH:24]=[CH:25][C:26]=2[CH3:27])[C:20]([O:22]C)=[O:21])=[N:13][CH:14]=1)=[O:7])([CH3:4])([CH3:3])[CH3:2].O[Li].O>C1COCC1.CO.O>[C:1]([O:5][C:6]([NH:8][C:9]1[N:10]=[CH:11][C:12]([CH2:15][NH:16][C:17]2[CH:18]=[C:19]([CH:24]=[CH:25][C:26]=2[CH3:27])[C:20]([OH:22])=[O:21])=[N:13][CH:14]=1)=[O:7])([CH3:4])([CH3:3])[CH3:2] | 1 |
OC1=NC=CC=C1.FC=1C=C(C#N)C=CC1I>>FC=1C=C(C#N)C=CC1N1C(C=CC=C1)=O | 5 |
ClC1=CC(=NC=C1C#N)OC>>Cl.ClC1=CC(=NC=C1C(=N)N)OC | 5 |
[CH3:1][C:2]([CH3:5])([O-])[CH3:3].[K+].O1CCCC1.[C:12]([C:15]1[CH:16]=[N:17][CH:18]=CC=1)(=O)C>[Br-].C[P+](C1C=CC=CC=1)(C1C=CC=CC=1)C1C=CC=CC=1.O>[CH3:1][C:2]([C:5]1[CH:18]=[N:17][CH:16]=[CH:15][CH:12]=1)=[CH2:3] | 2 |
ClCCC(OCC)OCC.C(CCCCCC\C=C/C\C=C/CCCCC)C(C(CCCCCCC\C=C/C\C=C/CCCCC)O)C(CCCCCCCC\C=C/C\C=C/CCCCC)O>>C(CCCCCC\C=C/C\C=C/CCCCC)C1OC(OC(C1CCCCCCC\C=C/C\C=C/CCCCC)CCCCCCCC\C=C/C\C=C/CCCCC)CCN(C)C | 5 |
[CH2:1]([OH:4])[CH2:2][OH:3].[H-].[Na+].F[C:8]1[CH:9]=[CH:10][C:11]([CH:14]=[O:15])=[N:12][CH:13]=1.O>ClCCCl>[OH:3][CH2:2][CH2:1][O:4][C:8]1[CH:9]=[CH:10][C:11]([CH:14]=[O:15])=[N:12][CH:13]=1 | 2 |
OC1=C(C(NC2=CC=CC=C12)=O)C(=O)N(CC1=CC=C(C=C1)OC)CC1=CC=C(C=C1)OC>CCN(CC)CC.P(=O)(Cl)(Cl)Cl>ClC1=C(C(NC2=CC=CC=C12)=O)C(=O)N(CC1=CC=C(C=C1)OC)CC1=CC=C(C=C1)OC | 3 |
OC1=C(C=O)C=C(C=C1)O.CN(C)CCN1C(=O)C=2C=CC=C3C2C(=CC(=C3)N)C1=O>C1(=CC=CC=C1)C>CN(CCN1C(C2=CC=CC=3C2=C(C1=O)C=C(C3)\N=C/C3=C(C=CC(=C3)O)O)=O)C | 3 |
[CH2:1]([NH:3][C:4]1[CH:9]=[CH:8][C:7]([F:10])=[CH:6][CH:5]=1)[CH3:2].Cl[CH2:12][C:13]1[N:14]=[C:15]2[S:22][CH:21]=[C:20]([CH:23]3[CH2:25][C:24]3([CH2:28][OH:29])[C:26]#[N:27])[N:16]2[C:17](=[O:19])[CH:18]=1>C(#N)C>[CH2:1]([N:3]([CH2:12][C:13]1[N:14]=[C:15]2[S:22][CH:21]=[C:20]([CH:23]3[CH2:25][C:24]3([CH2:28][OH:29])[C:26]#[N:27])[N:16]2[C:17](=[O:19])[CH:18]=1)[C:4]1[CH:9]=[CH:8][C:7]([F:10])=[CH:6][CH:5]=1)[CH3:2] | 2 |
COC=1C=C(C(=O)OCC)C=CC1OCCOC>O.C1CCCO1.CO[H].O[Li].O>COC=1C=C(C(=O)O)C=CC1OCCOC | 3 |
ClC(=O)OCC1=CC=CC=C1.NC=1C2=C(N=C(N1)Cl)N(C=C2)[C@H]2C[C@@H]([C@@](O2)(C#C)CO[Si](C)(C)C(C)(C)C)O>C1(=CC=NC=C1)N(C)C.ClCCl.CCN(CC)CC>C(O[C@@H]1[C@@](O[C@H](C1)N1C=CC2=C1N=C(N=C2N)Cl)(C#C)CO[Si](C)(C)C(C)(C)C)(OCC2=CC=CC=C2)=O | 3 |
NC1=CC(=C(S1)C(=O)OC)O[C@H](C)C1=C(C=CC=C1)C(F)(F)F.BrC1=C(C=CC(=C1)OCOC)[N+](=O)[O-]>O1CCOCC1.[Pd].[Pd].O=C(\C=C\c1ccccc1)\C=C\c2ccccc2.O=C(\C=C\c1ccccc1)\C=C\c2ccccc2.O=C(\C=C\c1ccccc1)\C=C\c2ccccc2.C1(=CC=CC=C1)P(C1=CC=CC=2C(C3=CC=CC(=C3OC12)P(C1=CC=CC=C1)C1=CC=CC=C1)(C)C)C1=CC=CC=C1.C(=O)([O-])[O-].[Cs+].[Cs+]>COCOC=1C=CC(=C(C1)NC1=CC(=C(S1)C(=O)OC)O[C@H](C)C1=C(C=CC=C1)C(F)(F)F)[N+](=O)[O-] | 3 |
FC1=C(C(=CC=C1)F)C1CCN(CC1)C1=C(C=CC=C1)CO>ClCCl.c1ccncc1.P(Br)(Br)Br>BrCC1=C(C=CC=C1)N1CCC(CC1)C1=C(C=CC=C1F)F | 3 |
Br[CH2:2][C:3]([C:5]1[CH:10]=[CH:9][C:8]([Cl:11])=[CH:7][CH:6]=1)=[O:4].[CH2:12]([O:14][C:15]1[CH:22]=[CH:21][CH:20]=[C:17]([CH:18]=O)[C:16]=1[OH:23])[CH3:13]>C(O)C.O.[Na]>[CH2:12]([O:14][C:15]1[C:16]2[O:23][C:2]([C:3]([C:5]3[CH:10]=[CH:9][C:8]([Cl:11])=[CH:7][CH:6]=3)=[O:4])=[CH:18][C:17]=2[CH:20]=[CH:21][CH:22]=1)[CH3:13] | 1 |
BrC1=C(C=CC(=C1)F)S(=O)(=O)N>CC#N.COC(N(C)C)OC>BrC1=C(C=CC(=C1)F)S(=O)(=O)N=CN(C)C | 3 |
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