smiles stringlengths 15 6.12k | source_id int64 1 5 |
|---|---|
[O:1]1[C:6]2[CH:7]=[CH:8][C:9]([O:11][CH:12]3[CH2:17][CH2:16][NH:15][CH2:14][CH2:13]3)=[CH:10][C:5]=2[O:4][CH2:3][CH2:2]1.[H-].[Na+].C(OC([N:27]1[C:31]2=[N:32][CH:33]=[C:34]([C:36]#[N:37])[CH:35]=[C:30]2[C:29]([CH2:38][CH2:39][CH2:40][CH2:41]OS(C)(=O)=O)=[CH:28]1)=O)(C)(C)C>CN(C=O)C>[O:1]1[C:6]2[CH:7]=[CH:8][C:9]([O:11][CH:12]3[CH2:17][CH2:16][N:15]([CH2:41][CH2:40][CH2:39][CH2:38][C:29]4[C:30]5[C:31](=[N:32][CH:33]=[C:34]([C:36]#[N:37])[CH:35]=5)[NH:27][CH:28]=4)[CH2:14][CH2:13]3)=[CH:10][C:5]=2[O:4][CH2:3][CH2:2]1 | 2 |
[Mg].Br[CH:3]([C:5]1[CH:6]=[CH:7][C:8]2[O:17][C:12]3=[N:13][CH:14]=[CH:15][CH:16]=[C:11]3[CH2:10][C:9]=2[CH:18]=1)[CH3:4].[C:19](=[O:21])=[O:20].Cl>O1CCCC1>[N:13]1[CH:14]=[CH:15][CH:16]=[C:11]2[CH2:10][C:9]3[CH:18]=[C:5]([CH:3]([CH3:4])[C:19]([OH:21])=[O:20])[CH:6]=[CH:7][C:8]=3[O:17][C:12]=12 | 1 |
[CH:1]([N:4]([CH3:13])[C:5]1[CH:12]=[CH:11]C(C#N)=[CH:7][N:6]=1)([CH3:3])[CH3:2].[OH-:14].[K+].[CH2:16]([OH:18])[CH3:17]>>[CH:1]([N:4]([CH3:13])[C:5]1[CH:12]=[CH:11][C:17]([C:16]([OH:14])=[O:18])=[CH:7][N:6]=1)([CH3:3])[CH3:2] | 2 |
O=[C:2]([CH3:14])[CH:3]([C:8]1[CH:13]=[CH:12][CH:11]=[CH:10][CH:9]=1)[C:4](OC)=[O:5].O.[NH2:16][NH2:17]>C(O)C>[CH3:14][C:2]1[C:3]([C:8]2[CH:13]=[CH:12][CH:11]=[CH:10][CH:9]=2)=[C:4]([OH:5])[NH:17][N:16]=1 | 2 |
ClC1=CC=C(C[C@H](C(=O)N2CCC(CC2)(CN2N=CN=C2)C2CCCCC2)NC2CCN(CC2)C(=O)NC2=CC=CC=C2)C=C1>>Cl.ClC1=CC=C(C[C@H](C(=O)N2CCC(CC2)(CN2N=CN=C2)C2CCCCC2)NC2CCN(CC2)C(=O)NC2=CC=CC=C2)C=C1 | 5 |
COC=1C=C2C=CC(=CC2=CC1)C(C(=O)OC)C>CO[H].Cl.[OH-].[Na+]>COC=1C=C2C=CC(=CC2=CC1)C(C(=O)O)C | 3 |
C(C1=CC=CC=C1)(C1=CC=CC=C1)(C1=CC=CC=C1)N1N=CC(=C1)I.[N+](=O)([O-])C1=CC=C(C=C1)C1CCNCC1>[Cu]I.O.CS(=O)C.N1[C@H](C(=O)O)CCC1.P(=O)([O-])([O-])[O-].[K+].[K+].[K+].[Cu]>[N+](=O)([O-])C1=CC=C(C=C1)C1CCN(CC1)C=1C=NN(C1)C(C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1 | 3 |
[C:1](OCC)(=O)CC(OCC)=O.[H-].[Na+].Cl[C:15]1[CH:20]=[C:19]([CH2:21][CH2:22][CH3:23])[N:18]=[C:17]([C:24]2[CH:29]=[CH:28][CH:27]=[C:26]([O:30][C:31]3[CH:36]=[CH:35][CH:34]=[CH:33][C:32]=3[Cl:37])[N:25]=2)[N:16]=1.[OH-].[Na+].S(=O)(=O)(O)O.C(=O)([O-])[O-].[Na+].[Na+]>O.CO.O1CCCC1>[Cl:37][C:32]1[CH:33]=[CH:34][CH:35]=[CH:36][C:31]=1[O:30][C:26]1[N:25]=[C:24]([C:17]2[N:16]=[C:15]([CH3:1])[CH:20]=[C:19]([CH2:21][CH2:22][CH3:23])[N:18]=2)[CH:29]=[CH:28][CH:27]=1 | 1 |
[N+:1]([C:4]1[CH:9]=[CH:8][C:7]([C:10]2[S:14][C:13]([CH2:15][CH2:16][C:17]([O:19][CH3:20])=[O:18])=[N:12][CH:11]=2)=[CH:6][CH:5]=1)([O-])=O.O1CCCC1.O.[Cl-].[NH4+]>C(O)C.[Fe]>[NH2:1][C:4]1[CH:5]=[CH:6][C:7]([C:10]2[S:14][C:13]([CH2:15][CH2:16][C:17]([O:19][CH3:20])=[O:18])=[N:12][CH:11]=2)=[CH:8][CH:9]=1 | 2 |
CN(CCC(=O)O)C.C(CCC)OC1=NN2C(C(=N1)N)=NC=C2CC=2C=NC(=C(C2)C)N2CCNCC2>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>NC1=NC(=NN2C1=NC=C2CC=2C=C(C(=NC2)N2CCN(CC2)C(CCN(C)C)=O)C)OCCCC | 3 |
BrCC(=O)OC(C)(C)C.N1N=C(C2=C1CCC2)C(=O)OCC>>C(C)(C)(C)OC(CN1N=C(C2=C1CCC2)C(=O)OCC)=O | 5 |
[H][H].[C:3](#N)[CH2:4][CH3:5].C(N)CC.[CH2:11]([NH:14][CH2:15][CH2:16][CH3:17])[CH2:12][CH3:13]>[C-]#[W]>[CH2:11]([N:14]([CH2:3][CH2:4][CH3:5])[CH2:15][CH2:16][CH3:17])[CH2:12][CH3:13] | 1 |
C1(CCC1)CN1[C@H]2[C@@H]3CCC4(OCCO4)[C@H]4[C@]3(CC1)C1=C(O4)C(=CC=C1C2)C#N>ClCCl.Cl>C1(CCC1)CN1[C@H]2[C@@H]3CCC([C@H]4[C@]3(CC1)C1=C(O4)C(=CC=C1C2)C#N)=O | 3 |
Cl.NCC1=C(C=2C(=C3C=C(N=CC3=CC2)\C=C\C2=CC=CC=C2)N1)C(=O)O>>C(=C\C1=CC=CC=C1)/C=1N=CC=2C=CC3=C(C2C1)NC=1CNC(C13)=O | 5 |
[CH3:1][C:2]1[O:6][N:5]=[C:4]([NH:7][S:8]([C:11]2[CH:12]=[CH:13][C:14]([NH2:17])=[CH:15][CH:16]=2)(=[O:10])=[O:9])[CH:3]=1.[CH2:18]([OH:29])[C@H:19]1[O:25][C:23](=[O:24])[C@H:22]([OH:26])[C@@H:21]([OH:27])[C@@H:20]1[OH:28].C([N:32](CC)CC)C>C(#N)C>[CH3:1][C:2]1[O:6][N:5]=[C:4]([NH:7][S:8]([C:11]2[CH:16]=[CH:15][C:14]([NH2:17])=[CH:13][CH:12]=2)(=[O:10])=[O:9])[CH:3]=1.[O:24]=[C:23]([NH2:32])[C@@H:22]([C@H:21]([C@@H:20]([C@@H:19]([CH2:18][OH:29])[OH:25])[OH:28])[OH:27])[OH:26] | 2 |
Cl[C:2]1[N:7]=[C:6]([NH:8][C:9]2[C:18]([F:19])=[CH:17][CH:16]=[CH:15][C:10]=2[C:11]([NH:13][CH3:14])=[O:12])[C:5]([Cl:20])=[CH:4][N:3]=1.[NH2:21][C:22]1[CH:23]=[CH:24][C:25]2[CH2:31][CH2:30][CH2:29][NH:28][C:27](=[O:32])[C:26]=2[CH:33]=1.CC1(C)[C@]2(CS(O)(=O)=O)C(C[C@H]1CC2)=O>C(O)(C)C>[Cl:20][C:5]1[C:6]([NH:8][C:9]2[C:18]([F:19])=[CH:17][CH:16]=[CH:15][C:10]=2[C:11]([NH:13][CH3:14])=[O:12])=[N:7][C:2]([NH:21][C:22]2[CH:23]=[CH:24][C:25]3[CH2:31][CH2:30][CH2:29][NH:28][C:27](=[O:32])[C:26]=3[CH:33]=2)=[N:3][CH:4]=1 | 1 |
COC=1C=C2C(=NC(=NC2=CC1)C=1C=NC=CC1)NC>>CNC1=NC(=NC2=CC=C(C=C12)O)C=1C=NC=CC1 | 5 |
COCCBr.ClC=1N=CC=C2C=CNC12>N(C)(C)C=O.[I-].[Na+].[H-].[Na+]>ClC=1N=CC=C2C1N(C=C2)CCOC | 3 |
Cl.C1(CC1)C1NCCS(C1)(=O)=O>>C1(CC1)C1NCCS(C1)(=O)=O | 5 |
CC(C)(C)[S@@](=O)N.CC=1C2=C(SC1C(C)=O)C=CC=C2>>CC=1C2=C(SC1C(C)=N[S@](=O)C(C)(C)C)C=CC=C2 | 5 |
CN([C@H]1C[C@H](C1)NC(OC(C)(C)C)=O)C1=NC=C(N=C1)C(F)(F)F>CO[H].Cl.O1CCOCC1>CN([C@@H]1C[C@@H](C1)N)C1=NC=C(N=C1)C(F)(F)F | 3 |
ClC(=O)OCCCC.C1(=CC=CC=C1)C=1N(C=CN1)CC=1C=C(C=CC1)C1=C(SC(=C1)CC(C)C)S(=O)(=O)NC(C)(C)C>ClCCl.B(Cl)(Cl)Cl>C(CCC)OC(=O)NS(=O)(=O)C=1SC(=CC1C1=CC(=CC=C1)CN1C(=NC=C1)C1=CC=CC=C1)CC(C)C | 3 |
ClCC(=O)Cl.C(C)(C)C1=C(N)C(=CC=C1)C(C)C>>ClCC(=O)NC1=C(C=CC=C1C(C)C)C(C)C | 5 |
[C:1]([C:3]1[CH:8]=[CH:7][C:6]([S:9]([NH:12][C:13]2[CH:14]=[CH:15][CH:16]=[C:17]3[C:22]=2[N:21]=[CH:20][CH:19]=[CH:18]3)(=[O:11])=[O:10])=[C:5]([N+:23]([O-])=O)[CH:4]=1)#[N:2].Cl[Sn]Cl>Cl.CCO>[NH2:23][C:5]1[CH:4]=[C:3]([C:1]#[N:2])[CH:8]=[CH:7][C:6]=1[S:9]([NH:12][C:13]1[CH:14]=[CH:15][CH:16]=[C:17]2[C:22]=1[N:21]=[CH:20][CH:19]=[CH:18]2)(=[O:11])=[O:10] | 1 |
COCC(=O)Cl.ClC1=NC=CC(=N1)N>N(C)(C)C=O.[H-].[Na+].C(O)([O-])=O.[Na+]>ClC1=NC=CC(=N1)NC(COC)=O | 3 |
[NH2:1][C:2]1[C:3]([I:29])=[C:4]([CH2:24][O:25][C:26](=[O:28])[CH3:27])[C:5]([I:23])=[C:6]([C:21]=1[I:22])[C:7]([NH:9][CH2:10][CH:11]([O:17][C:18](=[O:20])[CH3:19])[CH2:12][O:13][C:14](=[O:16])[CH3:15])=[O:8].[C:30]([O:33][CH2:34][C:35]([CH2:44][O:45][C:46](=[O:48])[CH3:47])([CH2:39][O:40][C:41](=[O:43])[CH3:42])[C:36](Cl)=[O:37])(=[O:32])[CH3:31].C(=O)([O-])O.[Na+]>CC(N(C)C)=O>[C:41]([O:40][CH2:39][C:35]([CH2:44][O:45][C:46](=[O:48])[CH3:47])([CH2:34][O:33][C:30](=[O:32])[CH3:31])[C:36]([NH:1][C:2]1[C:3]([I:29])=[C:4]([CH2:24][O:25][C:26](=[O:28])[CH3:27])[C:5]([I:23])=[C:6]([C:21]=1[I:22])[C:7]([NH:9][CH2:10][CH:11]([O:17][C:18](=[O:20])[CH3:19])[CH2:12][O:13][C:14](=[O:16])[CH3:15])=[O:8])=[O:37])(=[O:43])[CH3:42] | 1 |
C(C)(C)(C)C1=CC=C(C=C1)C1=CC(=NO1)C(=O)OCC>C(C)(=O)O.ClN1C(CCC1=O)=O>C(C)(C)(C)C1=CC=C(C=C1)C1=C(C(=NO1)C(=O)OCC)Cl | 3 |
FC(C(=O)OCC)(F)F.C#CCCCC>>C(CCC)C1=CC(=NN1)C(F)(F)F | 5 |
C1(CC1)B(O)O.ClC=1C=C(C=CC1)N1C[C@H](OCC1)C>C1(=CC=CC=C1)C.O.[Pd+2].[O-]C(=O)C.[O-]C(=O)C.P(=O)([O-])([O-])[O-].[K+].[K+].[K+].C1(CCCCC1)P(C1CCCCC1)C1CCCCC1>C1(CC1)C=1C=C(C=CC1)N1C[C@H](OCC1)C | 3 |
[CH2:1]([O:8][C:9]1[C:14](=[O:15])[CH:13]=[C:12]([CH2:16][NH:17][S:18]([C:21]2[CH:26]=[CH:25][C:24]([CH3:27])=[CH:23][CH:22]=2)(=[O:20])=[O:19])[N:11]([CH3:28])[C:10]=1[C:29](O)=[O:30])[C:2]1[CH:7]=[CH:6][CH:5]=[CH:4][CH:3]=1.[CH3:32][NH:33]C(C1N(C)C(C(S(C2C=CC=CC=2)(=O)=O)N)=CC(=O)C=1OCC1C=CC=CC=1)=O>>[CH3:32][NH:33][C:29]([C:10]1[N:11]([CH3:28])[C:12]([CH2:16][NH:17][S:18]([C:21]2[CH:26]=[CH:25][C:24]([CH3:27])=[CH:23][CH:22]=2)(=[O:20])=[O:19])=[CH:13][C:14](=[O:15])[C:9]=1[O:8][CH2:1][C:2]1[CH:3]=[CH:4][CH:5]=[CH:6][CH:7]=1)=[O:30] | 1 |
[N:1]12[CH2:8][CH2:7][CH:4]([CH2:5][CH2:6]1)[CH2:3][CH:2]2[C:9](Cl)=[O:10].[NH2:12][C@H:13]1[CH2:17][CH2:16][N:15]([CH2:18][CH2:19][C:20]2[CH:25]=[CH:24][CH:23]=[CH:22][CH:21]=2)[CH2:14]1>>[C:20]1([CH2:19][CH2:18][N:15]2[CH2:16][CH2:17][CH:13]([NH:12][C:9]([C@@H:2]3[CH2:3][CH:4]4[CH2:7][CH2:8][N:1]3[CH2:6][CH2:5]4)=[O:10])[CH2:14]2)[CH:21]=[CH:22][CH:23]=[CH:24][CH:25]=1 | 1 |
N1=CC=C(C=C1)C.S(SCCNC(CCl)=O)CCNC(CCl)=O>>[Cl-].[Cl-].S(SCCNC(C[N+]1=CC=C(C=C1)C)=O)CCNC(C[N+]1=CC=C(C=C1)C)=O | 5 |
[O:1]1[C:5]([C:6]2[CH:11]=[CH:10][CH:9]=[CH:8][C:7]=2[S:12](Cl)(=[O:14])=[O:13])=[CH:4][CH:3]=[N:2]1.[OH-].[NH4+:17]>O1CCCC1>[O:1]1[C:5]([C:6]2[CH:11]=[CH:10][CH:9]=[CH:8][C:7]=2[S:12]([NH2:17])(=[O:14])=[O:13])=[CH:4][CH:3]=[N:2]1 | 1 |
C(C)(C)I.CC=1C=C(C=CC1O)C(C)=O>N(C)(C)C=O.C([O-])([O-])=O.[K+].[K+]>C(C)(C)OC1=C(C=C(C=C1)C(C)=O)C | 3 |
[CH3:1][C:2]1([CH3:16])[C:6]([CH3:8])([CH3:7])[O:5][B:4]([C:9]([CH2:11][O:12][CH2:13][CH:14]=C)=C)[O:3]1.N#N>C(Cl)Cl.Cl[Ru](=C1N(C2C(C)=CC(C)=CC=2C)CCN1C1C(C)=CC(C)=CC=1C)(Cl)(=CC1C=CC=CC=1)[P](C1CCCCC1)(C1CCCCC1)C1CCCCC1>[O:12]1[CH2:13][CH:14]=[C:9]([B:4]2[O:5][C:6]([CH3:7])([CH3:8])[C:2]([CH3:1])([CH3:16])[O:3]2)[CH2:11]1 | 2 |
BrC1=C(C=O)C=CC(=C1)Cl.O1C(CCCC1)N1N=CC(=C1)B1OC(C(O1)(C)C)(C)C>O.C([O-])([O-])=O.[K+].[K+].O1CCOCC1.c1ccc(cc1)[P](c2ccccc2)(c3ccccc3)[Pd]([P](c4ccccc4)(c5ccccc5)c6ccccc6)([P](c7ccccc7)(c8ccccc8)c9ccccc9)[P](c1ccccc1)(c1ccccc1)c1ccccc1>ClC1=CC(=C(C=O)C=C1)C=1C=NN(C1)C1OCCCC1 | 3 |
C(OC(N1CCC[C@@H]1C(O)=O)=O)(C)(C)C.COC1C=C(C=C(OC)C=1OC)C(O)=O.F[B-](F)(F)F.N1(OC(N(C)C)=[N+](C)C)C2C=CC=CC=2N=N1.C(OC([N:60]1[CH2:64][CH2:63][CH2:62][CH:61]1[CH2:65][CH2:66][N:67]([CH2:82][C:83]([CH3:91])=[CH:84][C:85]1[CH:90]=[CH:89][CH:88]=[CH:87][CH:86]=1)[C:68](=[O:81])[C:69]1[CH:74]=[C:73]([O:75][CH3:76])[C:72]([O:77][CH3:78])=[C:71]([O:79][CH3:80])[CH:70]=1)=O)(C)(C)C>O1CCOCC1.Cl.C(N(CC)CC)C>[CH3:80][O:79][C:71]1[CH:70]=[C:69]([CH:74]=[C:73]([O:75][CH3:76])[C:72]=1[O:77][CH3:78])[C:68]([N:67]([CH2:82][C:83]([CH3:91])=[CH:84][C:85]1[CH:86]=[CH:87][CH:88]=[CH:89][CH:90]=1)[CH2:66][CH2:65][C@H:61]1[CH2:62][CH2:63][CH2:64][NH:60]1)=[O:81] | 1 |
CC(=O)C1=CC(=CC=C1)[N+](=O)[O-]>C1(=CC=CC=C1)C.[F-].C(CCC)[N+](CCCC)(CCCC)CCCC.C[Si](C(F)(F)F)(C)C>NC=1C=C(C=CC1)C(C(F)(F)F)(C)O | 3 |
CI.C(C)(C)(C)OC(=O)N1C(CCC1)C1=C(C=CC=C1)Cl>C1CCCO1.CN(CCN(C)C)C.C(C)(CC)[Li]>C(C)(C)(C)OC(=O)N1C(CCC1)(C)C1=C(C=CC=C1)Cl | 3 |
CC1C(NC(C2SC=CC=2)=O)=C(C2C=CC=CC=2)NN=1.[CH2:21]([N:28]1[C:32]([C:33]2[CH:38]=[CH:37][CH:36]=[CH:35][CH:34]=2)=[C:31]([NH:39][C:40]([CH:42]2[CH2:47][CH2:46][CH2:45][CH2:44][CH2:43]2)=O)[C:30]([CH3:48])=[N:29]1)[C:22]1[CH:27]=[CH:26][CH:25]=[CH:24][CH:23]=1.O=P12OP3(OP(OP(O3)(O1)=O)(=O)O2)=O>P(Cl)(Cl)(Cl)=O>[CH2:21]([N:28]1[C:32]2[C:33]3[CH:38]=[CH:37][CH:36]=[CH:35][C:34]=3[C:40]([CH:42]3[CH2:47][CH2:46][CH2:45][CH2:44][CH2:43]3)=[N:39][C:31]=2[C:30]([CH3:48])=[N:29]1)[C:22]1[CH:27]=[CH:26][CH:25]=[CH:24][CH:23]=1 | 1 |
NC1=CC2=C(C(N1)=O)N=CN2[C@H]2[C@@H](OCC1=CC=CC=C1)[C@H](OCC1=CC=CC=C1)[C@H](O2)COCC2=CC=CC=C2>[HH].[Pd].C(C)(=O)O.COCCO>NC1=CC2=C(C(N1)=O)N=CN2[C@H]2[C@@H](O)[C@H](O)[C@H](O2)CO | 3 |
C([O:9][C@H:10]1[C@H:14]([O:15]C(=O)C2C=CC=CC=2)[C@@H:13]([CH2:24][O:25]C(=O)C2C=CC=CC=2)[O:12][C@@H:11]1[O:34][CH2:35][C@H:36]1[O:40][C@H:39]([CH:41]([CH3:51])[CH2:42][CH2:43][CH2:44][CH2:45][CH2:46][CH2:47][CH2:48][CH:49]=[CH2:50])[C@@H:38]([OH:52])[C@@H:37]1[OH:53])(=O)C1C=CC=CC=1>CO>[C@H:11]1([O:34][CH2:35][C@H:36]2[O:40][C@H:39]([CH:41]([CH3:51])[CH2:42][CH2:43][CH2:44][CH2:45][CH2:46][CH2:47][CH2:48][CH:49]=[CH2:50])[C@@H:38]([OH:52])[C@@H:37]2[OH:53])[O:12][C@H:13]([CH2:24][OH:25])[C@@H:14]([OH:15])[C@@H:10]1[OH:9] | 2 |
[CH:1]1([NH2:4])[CH2:3][CH2:2]1.C[Al](C)C.[Br:9][C:10]1[CH:11]=[C:12]2[C:16](=[CH:17][CH:18]=1)[C:15](=[O:19])[O:14][CH2:13]2.Cl>C(Cl)Cl>[Br:9][C:10]1[CH:18]=[CH:17][C:16]([C:15]([NH:4][CH:1]2[CH2:3][CH2:2]2)=[O:19])=[C:12]([CH2:13][OH:14])[CH:11]=1 | 2 |
C(C1=CC=CC=C1)O.O=C1CC(C1)C(=O)O>CCN(CC)CC.C1=CC=C(C=C1)OP(=O)(N=[N+]=[N-])OC2=CC=CC=C2.C1(=CC=CC=C1)C.C1CCOC1>C(C1=CC=CC=C1)OC(NC1CC(C1)=O)=O | 3 |
C(OC1CCN([C:11]2[CH:16]=[CH:15][C:14]([B:17]3[O:21][C:20]([CH3:23])([CH3:22])[C:19]([CH3:25])([CH3:24])[O:18]3)=[CH:13][CH:12]=2)CC1)(=O)C.BrC1C=CC([C:33]2([F:40])[CH2:38][CH2:37][N:36]([CH3:39])[CH2:35][CH2:34]2)=CC=1>CCOC(C)=O.O>[F:40][C:33]1([C:11]2[CH:12]=[CH:13][C:14]([B:17]3[O:18][C:19]([CH3:24])([CH3:25])[C:20]([CH3:22])([CH3:23])[O:21]3)=[CH:15][CH:16]=2)[CH2:38][CH2:37][N:36]([CH3:39])[CH2:35][CH2:34]1 | 1 |
[N+](=O)([O-])C=1C=C(C=CC1)O.C(C)C(CBr)CCCC>CCO[H].[OH-].[K+]>C(C)C(COC1=CC(=CC=C1)[N+](=O)[O-])CCCC | 3 |
[F:1][C:2]1[CH:7]=[CH:6][C:5]([C:8]2[N:9]=[CH:10][NH:11][CH:12]=2)=[CH:4][CH:3]=1.[H-].[Na+].Br[CH2:16][CH2:17][CH2:18][CH2:19][NH:20]C(=O)C1C(=CC=CC=1)C(N)=O>>[F:1][C:2]1[CH:3]=[CH:4][C:5]([C:8]2[N:9]=[CH:10][N:11]([CH2:16][CH2:17][CH2:18][CH2:19][NH2:20])[CH:12]=2)=[CH:6][CH:7]=1 | 1 |
CC=1C=C(CN)C=CC1>O.[O-2].[Ti+4].[O-2]>CC=1C=C(C=CC1)C=NCC1=CC(=CC=C1)C | 3 |
[CH2:1]([CH2:3][NH2:4])[OH:2].Cl[C:6]1[C:11]([N+:12]([O-:14])=[O:13])=[CH:10][CH:9]=[CH:8][C:7]=1[N+:15]([O-:17])=[O:16]>O1CCCC1.C(OCC)(=O)C>[N+:12]([C:11]1[CH:10]=[CH:9][CH:8]=[C:7]([N+:15]([O-:17])=[O:16])[C:6]=1[NH:4][CH2:3][CH2:1][OH:2])([O-:14])=[O:13] | 1 |
C(C)(C)(C)OC(=O)N(CCC1=CC=C(C=C1)S(=O)(=O)C=1C=CC(=C(C(=O)O)C1)NCC)C[C@H](O)C1=CC(=CC=C1)Cl>Cl.C(C)(=O)OCC>Cl.ClC=1C=C(C=CC1)[C@H](CNCCC1=CC=C(C=C1)S(=O)(=O)C=1C=CC(=C(C(=O)O)C1)NCC)O | 3 |
BrC1=CC2=C(CCO2)C=C1>>CSC1=CC2=C(CCO2)C=C1 | 5 |
C(O[C:4]1[C:5](=[O:17])[C:6](=[O:16])[C:7]=1[NH:8][C:9]1[CH:14]=[CH:13][CH:12]=[CH:11][C:10]=1[OH:15])C.[NH2:18][C:19]1[CH:24]=[CH:23][CH:22]=[CH:21][C:20]=1[C:25]1[CH:30]=[CH:29][CH:28]=[CH:27][CH:26]=1>CS(C)=O>[C:25]1([C:20]2[CH:21]=[CH:22][CH:23]=[CH:24][C:19]=2[NH:18][C:4]2[C:5](=[O:17])[C:6](=[O:16])[C:7]=2[NH:8][C:9]2[CH:14]=[CH:13][CH:12]=[CH:11][C:10]=2[OH:15])[CH:26]=[CH:27][CH:28]=[CH:29][CH:30]=1 | 1 |
[CH:1]1[C:6]2[O:7][C:8]3[CH:17]=[CH:16][CH:15]=[CH:14][C:9]=3[CH2:10][C:11](=O)[CH2:12][C:5]=2[CH:4]=[CH:3][CH:2]=1.O.[CH3:19][N:20]1[CH2:25][CH2:24][NH:23][CH2:22][CH2:21]1>CC1C=CC=CC=1>[CH3:19][N:20]1[CH2:25][CH2:24][N:23]([C:11]2[CH2:10][C:9]3[CH:14]=[CH:15][CH:16]=[CH:17][C:8]=3[O:7][C:6]3[CH:1]=[CH:2][CH:3]=[CH:4][C:5]=3[CH:12]=2)[CH2:22][CH2:21]1 | 1 |
ClCC1=CN=C2C=C(C(NC2=C1)=O)CC.C1(CC1)C1=C(C=CC(=N1)C(=O)NC)N1CCNCC1>CC#N.Cl.C(C)(C)N(C(C)C)CC.[I-].[K+]>C1(CC1)C1=C(C=CC(=N1)C(=O)NC)N1CCN(CC1)CC=1C=NC=2C=C(C(NC2C1)=O)CC | 3 |
FC(C1=CC=C(CBr)C=C1)(F)F.COC(CC1=C(NC2=NC=CC=C21)CC)=O>>COC(CC1=C(N(C2=NC=CC=C21)CC2=CC=C(C=C2)C(F)(F)F)CC)=O | 5 |
[CH3:1][N:2]1[CH2:14][CH2:13][C:5]2[NH:6][C:7]3[CH:8]=[CH:9][CH:10]=[CH:11][C:12]=3[C:4]=2[CH2:3]1.CC(C)([O-])C.[K+].[CH3:21][O:22][C:23](=[O:30])[CH2:24][CH2:25][CH2:26][CH2:27][CH2:28]Br>CN(C=O)C.C(OCC)(=O)C.O.[I-].[K+]>[CH3:21][O:22][C:23](=[O:30])[CH2:24][CH2:25][CH2:26][CH2:27][CH2:28][N:6]1[C:7]2[CH:8]=[CH:9][CH:10]=[CH:11][C:12]=2[C:4]2[CH2:3][N:2]([CH3:1])[CH2:14][CH2:13][C:5]1=2 | 1 |
C1COCCN1.ClS(=O)(=O)C=1C=C(C(=O)O)C=CC1>ClCCl>N1(CCOCC1)S(=O)(=O)C=1C=C(C(=O)O)C=CC1 | 3 |
C(C)N1CCNCC1.BrC1CN(CCN1)C1=CC=C(C=C1)C.CC(C=O)(C)C>ClCCl.CN1C(CCC1)=O>CC(CN1CCN(CC1)CC)(C(=O)N1CCN(CC1)C1=CC=C(C=C1)C)C | 3 |
ClC1=CC=C(C=N1)C(C(C(=O)OCC)CC1=CC(=CC=C1)OC(C(F)F)(F)F)=O>C(C)OCC.[BH4-].[Zn+2].[BH4-]>ClC1=CC=C(C=N1)C(C(C(=O)OCC)CC1=CC(=CC=C1)OC(C(F)F)(F)F)O | 3 |
BrC1=CC=C2CCC(C2=C1)=O.BrCC1=C(C=CC=C1)CCBr>>BrC1=CC=C2CC3(CC4=CC=CC=C4CC3)C(C2=C1)=O | 5 |
C(C1=CC=CC=C1)Br.OC=1C=C(C=O)C=CC1O>CC#N.[OH-].[Na+].C([O-])([O-])=O.[K+].[K+].C(C)(=O)OCC>C(C1=CC=CC=C1)OC1=C(C=C(C=O)C=C1)O | 3 |
[F:1][C:2]1[C:3]([C:17]([OH:19])=O)=[N:4][O:5][C:6]=1[C:7]1[CH:12]=[CH:11][C:10]([C:13]([F:16])([F:15])[F:14])=[CH:9][CH:8]=1.[NH2:20][C@@H:21]1[CH2:26][CH2:25][CH2:24][C@H:23]([OH:27])[CH2:22]1.O.ON1C2C=CC=CC=2N=N1.C(N(CC)CC)C.Cl.CN(C)CCCN=C=NCC>O1CCCC1>[F:1][C:2]1[C:3]([C:17]([NH:20][C@@H:21]2[CH2:26][CH2:25][CH2:24][C@H:23]([OH:27])[CH2:22]2)=[O:19])=[N:4][O:5][C:6]=1[C:7]1[CH:8]=[CH:9][C:10]([C:13]([F:14])([F:15])[F:16])=[CH:11][CH:12]=1 | 1 |
[CH2:1]([O:3][C:4]1[CH:12]=[C:11]2[C:7]([CH2:8][C@H:9]([NH:14][C:15](=O)[C:16](F)(F)F)[C:10]2=[O:13])=[CH:6][CH:5]=1)[CH3:2].[BH4-].[Na+].[O-]P([O-])([O-])=O.[Na+].[Na+].[Na+].[CH2:31](Br)[CH2:32][CH3:33].[CH2:35](O)C>>[CH2:15]([N:14]([CH2:31][CH2:32][CH3:33])[C@H:9]1[CH2:8][C:7]2[C:11](=[CH:12][C:4]([O:3][CH2:1][CH3:2])=[CH:5][CH:6]=2)[C@@H:10]1[OH:13])[CH2:16][CH3:35] | 1 |
C(O[CH2:5][C:6]1[C:11]([CH3:12])=[C:10]([O:13][CH3:14])[CH:9]=[CH:8][N:7]=1)(=O)C.S(Cl)(Cl)=O.[SH:19][C:20]1[NH:21][C:22]2[CH:28]=[CH:27][CH:26]=[CH:25][C:23]=2[N:24]=1.C[O-].[Na+]>C(Cl)(Cl)Cl.CO>[CH3:14][O:13][C:10]1[CH:9]=[CH:8][N:7]=[C:6]([CH2:5][S:19][C:20]2[NH:24][C:23]3[CH:25]=[CH:26][CH:27]=[CH:28][C:22]=3[N:21]=2)[C:11]=1[CH3:12] | 1 |
Cl[C:2]1[N:7]=[N:6][C:5]([O:8][CH3:9])=[C:4]([C:10](=[O:13])[CH2:11][CH3:12])[CH:3]=1.[CH3:14][C:15]1[CH:20]=[C:19](B2OC(C)(C)C(C)(C)O2)[CH:18]=[C:17]([CH3:30])[C:16]=1[OH:31].C(=O)([O-])[O-].[Na+].[Na+].C(=O)(O)[O-].[Na+]>COCCOC.[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.C(OCC)(=O)C>[OH:31][C:16]1[C:17]([CH3:30])=[CH:18][C:19]([C:2]2[N:7]=[N:6][C:5]([O:8][CH3:9])=[C:4]([C:10](=[O:13])[CH2:11][CH3:12])[CH:3]=2)=[CH:20][C:15]=1[CH3:14] | 1 |
[C:1]([O:5][C:6](=[O:20])[NH:7][CH:8]1[CH2:17][CH2:16][C:15]2[C:10](=[CH:11][CH:12]=[C:13]([CH:18]=O)[CH:14]=2)[CH2:9]1)([CH3:4])([CH3:3])[CH3:2].[NH:21]1[CH2:26][CH2:25][CH2:24][CH2:23][CH2:22]1.[BH-](OC(C)=O)(OC(C)=O)OC(C)=O.[Na+]>CN(C)C(=O)C>[C:1]([O:5][C:6](=[O:20])[NH:7][CH:8]1[CH2:17][CH2:16][C:15]2[C:10](=[CH:11][CH:12]=[C:13]([CH2:18][N:21]3[CH2:26][CH2:25][CH2:24][CH2:23][CH2:22]3)[CH:14]=2)[CH2:9]1)([CH3:4])([CH3:3])[CH3:2] | 1 |
ClCC1=CC=C(C=C1)N1N=CC=C1.C(C)C1=CC(=C(C(=O)OC)C=C1B1OC(C(O1)(C)C)(C)C)O>C([O-])([O-])=O.[Na+].[Na+].COCCOC.c1ccc(cc1)[P](c2ccccc2)(c3ccccc3)[Pd]([P](c4ccccc4)(c5ccccc5)c6ccccc6)([P](c7ccccc7)(c8ccccc8)c9ccccc9)[P](c1ccccc1)(c1ccccc1)c1ccccc1>N1(N=CC=C1)C1=CC=C(CC=2C(=CC(=C(C(=O)OC)C2)O)CC)C=C1 | 3 |
FC1=CC=C(C=C1)O.ClC1=NC(=CC(=N1)Cl)C(F)(F)F>O.C([O-])([O-])=O.[K+].[K+].C(C)(=O)OCC.CS(=O)C>ClC1=NC(=CC(=N1)OC1=CC=C(C=C1)F)C(F)(F)F | 3 |
CC(C)=[O:3].OS(O)(=O)=O.O=[Cr](=O)=O.[CH2:14]([O:16][C:17]([C:19]1[CH:29]=[C:22]2[C:23]([CH2:27][OH:28])=[CH:24][CH:25]=[CH:26][N:21]2[N:20]=1)=[O:18])[CH3:15].CC(C)=O>C(O)(C)C>[CH3:15][CH2:14][O:16][C:17]([C:19]1[CH:29]=[C:22]2[C:23]([C:27]([OH:3])=[O:28])=[CH:24][CH:25]=[CH:26][N:21]2[N:20]=1)=[O:18] | 1 |
N1(CCCC1)C1CN(C1)C(=O)OC(C)(C)C>>Cl.Cl.N1CC(C1)N1CCCC1 | 5 |
CI.FC1(CC(C1)COC1=CC=C2CC3(C(C2=C1)=O)CCC(CC3)O)F>>FC1(CC(C1)COC1=CC=C2CC3(C(C2=C1)=O)CCC(CC3)OC)F | 5 |
ClC=1C(=C(C(=NC1)N1CCC(CC1)NC(OC(C)(C)C)=O)F)C1=NC=C(C=C1C)C>CO[H].Cl.O1CCOCC1>ClC=1C(=C(C(=NC1)N1CCC(CC1)N)F)C1=NC=C(C=C1C)C | 3 |
[Mg:1].[CH2:2]([O:6][CH2:7][CH2:8][CH2:9][CH3:10])[CH2:3][CH2:4][CH3:5].C([Cl:15])CCC>>[CH2:2]([O:6][CH2:7][CH2:8][CH2:9][CH3:10])[CH2:3][CH2:4][CH3:5].[CH2:2]([Mg:1][Cl:15])[CH2:3][CH2:4][CH3:5] | 1 |
[C:1]1([CH3:15])[CH:6]=[CH:5][CH:4]=[CH:3][C:2]=1[C:7]1[CH:14]=[CH:13][C:10]([CH:11]=[O:12])=[CH:9][N:8]=1.[BH4-].[Na+]>C(O)C>[C:1]1([CH3:15])[CH:6]=[CH:5][CH:4]=[CH:3][C:2]=1[C:7]1[N:8]=[CH:9][C:10]([CH2:11][OH:12])=[CH:13][CH:14]=1 | 1 |
C(C)N(C(=O)Cl)CC.CC1=[N+](C=CC=C1C)[O-]>ClCCl.C[Si](C)(C)C#N>CC=1C=CC(=NC1C)C#N | 3 |
C12(CC3CC(CC(C1)C3)C2)CC(=O)O>O.BrBr.ClS(Cl)=O>BrC(C(=O)O)C12CC3CC(CC(C1)C3)C2 | 3 |
ClC=1C(=NC=C(C1C(O)C=1N(C2=CC(=CC(=C2C1)C)C(F)(F)F)S(=O)(=O)C1=CC=CC=C1)Cl)OC>C(Cl)(Cl)(Cl)[H].ClS(Cl)=O.[Zn].C(C)(=O)O.C(O)([O-])=O.[Na+]>ClC=1C(=NC=C(C1CC=1N(C2=CC(=CC(=C2C1)C)C(F)(F)F)S(=O)(=O)C1=CC=CC=C1)Cl)OC | 3 |
C1(CCCC1)NC1=NC=CC(=N1)C=1C(=NN2C1C=CC(=C2)NC(OC(C)(C)C)=O)C2=CC=C(C=C2)F>ClCCl.Cl>Cl.Cl.C1(CCCC1)NC1=NC=CC(=N1)C=1C(=NN2C1C=CC(=C2)N)C2=CC=C(C=C2)F | 3 |
ClC1=C(C(=O)NC2=CC(=NN2C2=CC=CC=C2)C(=O)O)C=C(C(=C1)F)C1=NC=CC=C1>N(C)(C)C=O.C(C)(C)N(C(C)C)CC.[B-](F)(F)(F)F.CN(C)C(=[N+](C)C)ON1C=CC=CC1=O>ClC1=C(C(=O)NC2=CC(=NN2C2=CC=CC=C2)C(=O)NCCO)C=C(C(=C1)F)C1=NC=CC=C1 | 3 |
C(C)OC(CC=1C=C(C(=CC1)OC)C1=C(C=C(C=C1)C(F)(F)F)CN1C(O[C@@H]([C@@H]1C)C1=CC=CC=C1)=O)=O>C(C)(=O)O.Br>OC1=CC=C(C=C1C1=C(C=C(C=C1)C(F)(F)F)CN1C(O[C@@H]([C@@H]1C)C1=CC=CC=C1)=O)CC(=O)O | 3 |
C(C#C)N1CCOCC1.C(C)OC(COC1=C(C=C(C=C1)SC1=CC(=CC(=C1)C#CC1=CC=C(C=C1)CO)OCCC1=CC=C(C=C1)Cl)C)=O.C(C)OC(COC1=C(C=C(C=C1)SC1=CC(=CC(=C1)OC1CCCC1)Br)C)=O>>C(C)OC(COC1=C(C=C(C=C1)SC1=CC(=CC(=C1)C#CCN1CCOCC1)OCC(CC)CC)C)=O | 5 |
[OH:1][NH:2][C:3]([C:5]1[CH:10]=[CH:9][C:8]([CH2:11][C:12]([O:14]C)=[O:13])=[CH:7][CH:6]=1)=[NH:4]>Cl>[OH:1][NH:2][C:3]([C:5]1[CH:6]=[CH:7][C:8]([CH2:11][C:12]([OH:14])=[O:13])=[CH:9][CH:10]=1)=[NH:4] | 1 |
CC(C(=O)Cl)C.FC1=C(C(=CC(=C1)I)F)[C@H]1N[C@@H](CC2=C1NC1=CC=CC=C21)C>>FC1=C(C(=CC(=C1)I)F)[C@H]1N([C@@H](CC2=C1NC1=CC=CC=C21)C)C(C(C)C)=O | 5 |
Cl.C[C@@H]1CNCCC1.C(C)(C)(C)OC(=O)N[C@@H](C(=O)O)C=1C=NN(C1)C>ClCCl.CCN(CC)CC.CCCP1(=O)OP(=O)(OP(=O)(O1)CCC)CCC>CN1N=CC(=C1)[C@H](C(=O)N1C[C@H](CCC1)C)NC(OC(C)(C)C)=O | 3 |
Cl.C1(CCCCC1)N1CCN(CC1)C(CN)C1=CC=C(C=C1)OC.CC=1C=C(C=C(C1)C)CC(=O)O>ClCCl.CN1CCOCC1.CN(C)C(=[N+](C)C)ON1C2=C(C=CC=C2)N=N1.[B-](F)(F)(F)F>C1(CCCCC1)N1CCN(CC1)C(CNC(CC1=CC(=CC(=C1)C)C)=O)C1=CC=C(C=C1)OC | 3 |
[I-].[K+].[CH2:3]([N:5]([CH2:30][CH3:31])[C:6]([C:8]1[N:12]=[C:11]([CH2:13]Cl)[N:10]([C:15]2[CH:20]=[CH:19][C:18]([Cl:21])=[CH:17][C:16]=2[C:22](=O)[C:23]2[CH:28]=[CH:27][CH:26]=[CH:25][CH:24]=2)[N:9]=1)=[O:7])[CH3:4].[NH3:32]>O.O1CCOCC1>[CH2:30]([N:5]([CH2:3][CH3:4])[C:6]([C:8]1[N:12]=[C:11]2[CH2:13][N:32]=[C:22]([C:23]3[CH:24]=[CH:25][CH:26]=[CH:27][CH:28]=3)[C:16]3[CH:17]=[C:18]([Cl:21])[CH:19]=[CH:20][C:15]=3[N:10]2[N:9]=1)=[O:7])[CH3:31] | 1 |
[CH3:1][C:2]1[CH:11]=[CH:10][C:5]2[C:6]([OH:9])=[N:7][O:8][C:4]=2[CH:3]=1.[Br:12]Br>C(O)(=O)C>[Br:12][C:11]1[C:2]([CH3:1])=[CH:3][C:4]2[O:8][N:7]=[C:6]([OH:9])[C:5]=2[CH:10]=1 | 1 |
[N+](=O)([O-])C=1C=CC=2OCC(NC2N1)=O>CO[H].Cl.[HH].[Pd]>NC=1C=CC=2OCC(NC2N1)=O | 3 |
NC1=NC(=C2NC=NC2=N1)Cl.C1(=CC=CC=C1)C1OC[C@]2(C[C@H]2CO1)CO>c3c(P(c1ccccc1)c2ccccc2)cccc3.N(=NC(=O)OC(C)C)C(=O)OC(C)C.CC1OCCC1>ClC1=C2N=CN(C2=NC(=N1)N)C[C@]12COC(OC[C@@H]2C1)C1=CC=CC=C1 | 3 |
C[O:2][C:3](=[O:33])[CH2:4][O:5][C:6]1[CH:14]=[CH:13][C:12]([S:15][CH2:16][C:17]2[CH:22]=[CH:21][C:20]([O:23][CH2:24][C:25]3[CH:30]=[CH:29][C:28]([Cl:31])=[CH:27][C:26]=3[Cl:32])=[CH:19][CH:18]=2)=[C:11]2[C:7]=1[CH2:8][CH2:9][CH2:10]2.[K+].[Br-]>>[Cl:32][C:26]1[CH:27]=[C:28]([Cl:31])[CH:29]=[CH:30][C:25]=1[CH2:24][O:23][C:20]1[CH:19]=[CH:18][C:17]([CH2:16][S:15][C:12]2[CH:13]=[CH:14][C:6]([O:5][CH2:4][C:3]([OH:33])=[O:2])=[C:7]3[C:11]=2[CH2:10][CH2:9][CH2:8]3)=[CH:22][CH:21]=1 | 1 |
CS(=O)(=O)OCCCS(=O)(=O)C1=CC(=CC=C1)OC1=CC(=C(C=C1)Cl)C1=NC2=CC=CC(=C2N=C1C)C(F)(F)F>>ClC1=C(C=C(C=C1)OC1=CC(=CC=C1)S(=O)(=O)CCCF)C1=NC2=CC=CC(=C2N=C1C)C(F)(F)F | 5 |
ClC=1C=CC(=NC1)[C@](CC1=CC=CC=C1)(C1=CC(=CC(=C1)OC(C(F)F)(F)F)F)NC(NCC(CCC(=O)O)C(F)(F)F)=O>C1CCCO1.[H-].[Al+3].[Li+].[H-].[H-].[H-]>ClC=1C=CC(=NC1)[C@](CC1=CC=CC=C1)(C1=CC(=CC(=C1)OC(C(F)F)(F)F)F)NC(=O)NCC(CCCO)C(F)(F)F | 3 |
BrC1=NC2=C3N=CC=CC3=CC=C2C=C1.C1(=CC(=CC=C1)C1=CC=C(C2=CC=CC=C12)B(O)O)C1=CC=CC=C1>>C1(=CC(=CC=C1)C=1C(=NC2=C3N=CC=CC3=CC=C2C1)C1=CC=CC2=CC=CC=C12)C1=CC=CC=C1 | 5 |
[OH-].[Na+:2].[O:3]1[CH:7]=[CH:6][CH:5]=[C:4]1[C:8]1[CH:16]=[CH:15][C:11]([C:12]([OH:14])=[O:13])=[C:10]([NH:17][C:18](=[O:28])[C:19]2[CH:24]=[C:23]([O:25][CH3:26])[CH:22]=[CH:21][C:20]=2[OH:27])[CH:9]=1>C(O)C>[O:3]1[CH:7]=[CH:6][CH:5]=[C:4]1[C:8]1[CH:16]=[CH:15][C:11]([C:12]([O-:14])=[O:13])=[C:10]([NH:17][C:18](=[O:28])[C:19]2[CH:24]=[C:23]([O:25][CH3:26])[CH:22]=[CH:21][C:20]=2[OH:27])[CH:9]=1.[Na+:2] | 1 |
[CH2:1]([O:3][C:4](=[O:22])[CH2:5][C@@H:6]([NH:13][C:14]1[C:19]([NH2:20])=[CH:18][N:17]=[C:16]([CH3:21])[CH:15]=1)[C:7]1[CH:12]=[CH:11][CH:10]=[CH:9][CH:8]=1)[CH3:2].C1N=CN([C:28](N2C=NC=C2)=[O:29])C=1>C1COCC1.C(OCC)(=O)C>[CH2:1]([O:3][C:4](=[O:22])[CH2:5][C@@H:6]([N:13]1[C:14]2[CH:15]=[C:16]([CH3:21])[N:17]=[CH:18][C:19]=2[NH:20][C:28]1=[O:29])[C:7]1[CH:8]=[CH:9][CH:10]=[CH:11][CH:12]=1)[CH3:2] | 1 |
BrC(CC)CC.O=S1(N=C2N(CC1)C=CC=C2C2=CC=C(C=C2)O)=O>[OH-].[Na+].C([O-])([O-])=O.[K+].[K+].[I-].[Na+].CS(=O)C>C(C)C(CC)OC1=CC=C(C=C1)C1=CC=CN2C1=NS(CC2)(=O)=O | 3 |
O1C(OCCC1)C1=CC=C(C=C1)C(=O)C1=C(C=CC=C1)C(F)(F)F>>FC(C1=C(C(=O)C2=CC=C(C=O)C=C2)C=CC=C1)(F)F | 5 |
BrC=1C=C2CC(CNC2=C(C1)[N+](=O)[O-])N(C)C>CCO[H].[HH].[Pd]C>CN(C1CNC2=C(C=CC=C2C1)N)C | 3 |
BrC1=CC(=C(C=C1C)C12CC(C1)(C2)I)Cl>O.C1CCCO1.[OH-].[Na+].[BH4-].[Li+].[Cl-].[In+3].[Cl-].[Cl-]>BrC1=CC(=C(C=C1C)C12CC(C1)C2)Cl | 3 |
NCCC(=O)NCCSC(C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1.C(C1=CC=CC=C1)OCC1(CC1)C(C(=O)O)O>C1CCCO1.C(C)(C)N(C(C)C)CC.OC1=CC=CC=2NN=NC21.[Cl-].[NH4+].CCN=C=NCCCN(C)C>C(C1=CC=CC=C1)OCC1(CC1)C(C(=O)NCCC(=O)NCCSC(C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1)O | 3 |
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