← 浏览数据集![[F:22][C:2]([F:1])([F:21])[CH2:3][S:4]([C:5]1[CH:10]=[C:9]([C:11]2[C:12]([C:16]([F:17])([F:18])[F:19])=[N:13][NH:14][CH:15]=2)[CH:8]=[CH:7][C:6]=1[CH3:20])=[O:24]](/api/mol/svg?smiles=%5BF%3A22%5D%5BC%3A2%5D(%5BF%3A1%5D)(%5BF%3A21%5D)%5BCH2%3A3%5D%5BS%3A4%5D(%5BC%3A5%5D1%5BCH%3A10%5D%3D%5BC%3A9%5D(%5BC%3A11%5D2%5BC%3A12%5D(%5BC%3A16%5D(%5BF%3A17%5D)(%5BF%3A18%5D)%5BF%3A19%5D)%3D%5BN%3A13%5D%5BNH%3A14%5D%5BCH%3A15%5D%3D2)%5BCH%3A8%5D%3D%5BCH%3A7%5D%5BC%3A6%5D%3D1%5BCH3%3A20%5D)%3D%5BO%3A24%5D&w=100&h=80)
![[Cl:27][C:17]1[CH:18]=[C:19]([C:23]([F:26])([F:24])[F:25])[CH:20]=[C:21]([Cl:22])[C:16]=1[C:14]1[CH:13]=[CH:12][C:11]([NH2:28])=[C:10]([S:9][CH:6]([CH3:8])[CH3:7])[CH:15]=1](/api/mol/svg?smiles=%5BCl%3A27%5D%5BC%3A17%5D1%5BCH%3A18%5D%3D%5BC%3A19%5D(%5BC%3A23%5D(%5BF%3A26%5D)(%5BF%3A24%5D)%5BF%3A25%5D)%5BCH%3A20%5D%3D%5BC%3A21%5D(%5BCl%3A22%5D)%5BC%3A16%5D%3D1%5BC%3A14%5D1%5BCH%3A13%5D%3D%5BCH%3A12%5D%5BC%3A11%5D(%5BNH2%3A28%5D)%3D%5BC%3A10%5D(%5BS%3A9%5D%5BCH%3A6%5D(%5BCH3%3A8%5D)%5BCH3%3A7%5D)%5BCH%3A15%5D%3D1&w=100&h=80)
([F:21])[F:19])=[N:15][NH:16][CH:17]=2)[CH:10]=[CH:9][C:6]=1[CH3:7])[CH2:2][CH3:3]](/api/mol/svg?smiles=%5BCH2%3A1%5D(%5BS%3A4%5D%5BC%3A5%5D1%5BCH%3A12%5D%3D%5BC%3A11%5D(%5BC%3A13%5D2%5BC%3A14%5D(%5BC%3A18%5D(%5BF%3A20%5D)(%5BF%3A21%5D)%5BF%3A19%5D)%3D%5BN%3A15%5D%5BNH%3A16%5D%5BCH%3A17%5D%3D2)%5BCH%3A10%5D%3D%5BCH%3A9%5D%5BC%3A6%5D%3D1%5BCH3%3A7%5D)%5BCH2%3A2%5D%5BCH3%3A3%5D&w=100&h=80)
![[F:1][C:2]([F:23])([F:22])[CH2:3][S:4][C:5]1[CH:12]=[C:11]([C:13]2[C:14]([C:18]([F:21])([F:20])[F:19])=[N:15][NH:16][CH:17]=2)[CH:10]=[CH:9][C:6]=1[CH:7]=[CH2:24]](/api/mol/svg?smiles=%5BF%3A1%5D%5BC%3A2%5D(%5BF%3A23%5D)(%5BF%3A22%5D)%5BCH2%3A3%5D%5BS%3A4%5D%5BC%3A5%5D1%5BCH%3A12%5D%3D%5BC%3A11%5D(%5BC%3A13%5D2%5BC%3A14%5D(%5BC%3A18%5D(%5BF%3A21%5D)(%5BF%3A20%5D)%5BF%3A19%5D)%3D%5BN%3A15%5D%5BNH%3A16%5D%5BCH%3A17%5D%3D2)%5BCH%3A10%5D%3D%5BCH%3A9%5D%5BC%3A6%5D%3D1%5BCH%3A7%5D%3D%5BCH2%3A24%5D&w=100&h=80)
![[CH3:20][S:21][C:2]1[CH:9]=[C:8]([C:10]2[CH:15]=[CH:14][C:13]([C:16]([F:19])([F:18])[F:17])=[CH:12][CH:11]=2)[CH:7]=[CH:6][C:3]=1[C:4]#[N:5]](/api/mol/svg?smiles=%5BCH3%3A20%5D%5BS%3A21%5D%5BC%3A2%5D1%5BCH%3A9%5D%3D%5BC%3A8%5D(%5BC%3A10%5D2%5BCH%3A15%5D%3D%5BCH%3A14%5D%5BC%3A13%5D(%5BC%3A16%5D(%5BF%3A19%5D)(%5BF%3A18%5D)%5BF%3A17%5D)%3D%5BCH%3A12%5D%5BCH%3A11%5D%3D2)%5BCH%3A7%5D%3D%5BCH%3A6%5D%5BC%3A3%5D%3D1%5BC%3A4%5D%23%5BN%3A5%5D&w=100&h=80)
![[SH:2][C:4]1[CH:11]=[C:10]([C:12]2[CH:17]=[CH:16][C:15]([C:18]([F:19])([F:20])[F:21])=[CH:14][CH:13]=2)[CH:9]=[CH:8][C:5]=1[C:6]#[N:7]](/api/mol/svg?smiles=%5BSH%3A2%5D%5BC%3A4%5D1%5BCH%3A11%5D%3D%5BC%3A10%5D(%5BC%3A12%5D2%5BCH%3A17%5D%3D%5BCH%3A16%5D%5BC%3A15%5D(%5BC%3A18%5D(%5BF%3A19%5D)(%5BF%3A20%5D)%5BF%3A21%5D)%3D%5BCH%3A14%5D%5BCH%3A13%5D%3D2)%5BCH%3A9%5D%3D%5BCH%3A8%5D%5BC%3A5%5D%3D1%5BC%3A6%5D%23%5BN%3A7%5D&w=100&h=80)
![[Cl:9][C:10]1[CH:11]=[C:12]([C:18]([F:21])([F:20])[F:19])[CH:13]=[C:14]([Cl:17])[C:15]=1[C:2]1[CH:7]=[CH:6][C:5]([CH3:8])=[CH:4][CH:3]=1](/api/mol/svg?smiles=%5BCl%3A9%5D%5BC%3A10%5D1%5BCH%3A11%5D%3D%5BC%3A12%5D(%5BC%3A18%5D(%5BF%3A21%5D)(%5BF%3A20%5D)%5BF%3A19%5D)%5BCH%3A13%5D%3D%5BC%3A14%5D(%5BCl%3A17%5D)%5BC%3A15%5D%3D1%5BC%3A2%5D1%5BCH%3A7%5D%3D%5BCH%3A6%5D%5BC%3A5%5D(%5BCH3%3A8%5D)%3D%5BCH%3A4%5D%5BCH%3A3%5D%3D1&w=100&h=80)
![[Cl:1][C:2]1[CH:7]=[C:6]([C:8]([F:9])([F:10])[F:11])[CH:5]=[C:4]([Cl:12])[C:3]=1[C:13]1[CH:18]=[CH:17][C:16]([CH3:19])=[C:15]([S:21]([Cl:20])(=[O:23])=[O:22])[CH:14]=1](/api/mol/svg?smiles=%5BCl%3A1%5D%5BC%3A2%5D1%5BCH%3A7%5D%3D%5BC%3A6%5D(%5BC%3A8%5D(%5BF%3A9%5D)(%5BF%3A10%5D)%5BF%3A11%5D)%5BCH%3A5%5D%3D%5BC%3A4%5D(%5BCl%3A12%5D)%5BC%3A3%5D%3D1%5BC%3A13%5D1%5BCH%3A18%5D%3D%5BCH%3A17%5D%5BC%3A16%5D(%5BCH3%3A19%5D)%3D%5BC%3A15%5D(%5BS%3A21%5D(%5BCl%3A20%5D)(%3D%5BO%3A23%5D)%3D%5BO%3A22%5D)%5BCH%3A14%5D%3D1&w=100&h=80)
=[CH:11][C:12]([C:14]([F:16])([F:17])[F:15])=[CH:13][C:8]=2[Cl:7])[CH:20]=[CH:21][C:22]=1[CH3:29])[C:23]1[CH:24]=[C:19]([C:9]2[C:8]([Cl:7])=[CH:13][C:12]([C:14]([F:17])([F:16])[F:15])=[CH:11][C:10]=2[Cl:18])[CH:20]=[CH:21][C:22]=1[CH3:29]](/api/mol/svg?smiles=%5BS%3A25%5D(%5BC%3A23%5D1%5BCH%3A24%5D%3D%5BC%3A19%5D(%5BC%3A9%5D2%5BC%3A10%5D(%5BCl%3A30%5D)%3D%5BCH%3A11%5D%5BC%3A12%5D(%5BC%3A14%5D(%5BF%3A16%5D)(%5BF%3A17%5D)%5BF%3A15%5D)%3D%5BCH%3A13%5D%5BC%3A8%5D%3D2%5BCl%3A7%5D)%5BCH%3A20%5D%3D%5BCH%3A21%5D%5BC%3A22%5D%3D1%5BCH3%3A29%5D)%5BC%3A23%5D1%5BCH%3A24%5D%3D%5BC%3A19%5D(%5BC%3A9%5D2%5BC%3A8%5D(%5BCl%3A7%5D)%3D%5BCH%3A13%5D%5BC%3A12%5D(%5BC%3A14%5D(%5BF%3A17%5D)(%5BF%3A16%5D)%5BF%3A15%5D)%3D%5BCH%3A11%5D%5BC%3A10%5D%3D2%5BCl%3A18%5D)%5BCH%3A20%5D%3D%5BCH%3A21%5D%5BC%3A22%5D%3D1%5BCH3%3A29%5D&w=100&h=80)
![[SH:19][C:2]1[CH:9]=[C:8]([C:10]2[C:11]([C:15]([F:18])([F:17])[F:16])=[N:12][NH:13][CH:14]=2)[CH:7]=[CH:6][C:3]=1[C:4]#[N:5]](/api/mol/svg?smiles=%5BSH%3A19%5D%5BC%3A2%5D1%5BCH%3A9%5D%3D%5BC%3A8%5D(%5BC%3A10%5D2%5BC%3A11%5D(%5BC%3A15%5D(%5BF%3A18%5D)(%5BF%3A17%5D)%5BF%3A16%5D)%3D%5BN%3A12%5D%5BNH%3A13%5D%5BCH%3A14%5D%3D2)%5BCH%3A7%5D%3D%5BCH%3A6%5D%5BC%3A3%5D%3D1%5BC%3A4%5D%23%5BN%3A5%5D&w=100&h=80)
([F:17])[F:18])=[N:12][NH:13][CH:14]=2)[CH:9]=[CH:2][C:3]=1[C:4]#[N:5])[C:2]1[CH:9]=[C:8]([C:10]2[C:11]([C:15]([F:16])([F:18])[F:17])=[N:12][NH:13][CH:14]=2)[CH:7]=[CH:6][C:3]=1[C:4]#[N:5]](/api/mol/svg?smiles=%5BS%3A1%5D(%5BC%3A6%5D1%5BCH%3A7%5D%3D%5BC%3A8%5D(%5BC%3A10%5D2%5BC%3A11%5D(%5BC%3A15%5D(%5BF%3A16%5D)(%5BF%3A17%5D)%5BF%3A18%5D)%3D%5BN%3A12%5D%5BNH%3A13%5D%5BCH%3A14%5D%3D2)%5BCH%3A9%5D%3D%5BCH%3A2%5D%5BC%3A3%5D%3D1%5BC%3A4%5D%23%5BN%3A5%5D)%5BC%3A2%5D1%5BCH%3A9%5D%3D%5BC%3A8%5D(%5BC%3A10%5D2%5BC%3A11%5D(%5BC%3A15%5D(%5BF%3A16%5D)(%5BF%3A18%5D)%5BF%3A17%5D)%3D%5BN%3A12%5D%5BNH%3A13%5D%5BCH%3A14%5D%3D2)%5BCH%3A7%5D%3D%5BCH%3A6%5D%5BC%3A3%5D%3D1%5BC%3A4%5D%23%5BN%3A5%5D&w=100&h=80)
![[Cl:19][C:4]1[CH:5]=[C:6]([F:18])[C:7]([C:9]2[N:10]([C:14]([F:16])([F:17])[F:15])[N:11]=[N:12][CH:13]=2)=[CH:8][CH:3]=1](/api/mol/svg?smiles=%5BCl%3A19%5D%5BC%3A4%5D1%5BCH%3A5%5D%3D%5BC%3A6%5D(%5BF%3A18%5D)%5BC%3A7%5D(%5BC%3A9%5D2%5BN%3A10%5D(%5BC%3A14%5D(%5BF%3A16%5D)(%5BF%3A17%5D)%5BF%3A15%5D)%5BN%3A11%5D%3D%5BN%3A12%5D%5BCH%3A13%5D%3D2)%3D%5BCH%3A8%5D%5BCH%3A3%5D%3D1&w=100&h=80)
![[CH3:12][C:5]1[C:6]([C:7]([F:10])([F:9])[F:8])=[N:14][NH:15][CH:4]=1](/api/mol/svg?smiles=%5BCH3%3A12%5D%5BC%3A5%5D1%5BC%3A6%5D(%5BC%3A7%5D(%5BF%3A10%5D)(%5BF%3A9%5D)%5BF%3A8%5D)%3D%5BN%3A14%5D%5BNH%3A15%5D%5BCH%3A4%5D%3D1&w=100&h=80)
![[Cl:1][C:2]1[CH:7]=[CH:6][CH:5]=[C:4]([C:15]2[C:14]([Cl:17])=[CH:13][C:12]([C:18]([F:19])([F:21])[F:20])=[CH:11][C:10]=2[Cl:9])[CH:3]=1](/api/mol/svg?smiles=%5BCl%3A1%5D%5BC%3A2%5D1%5BCH%3A7%5D%3D%5BCH%3A6%5D%5BCH%3A5%5D%3D%5BC%3A4%5D(%5BC%3A15%5D2%5BC%3A14%5D(%5BCl%3A17%5D)%3D%5BCH%3A13%5D%5BC%3A12%5D(%5BC%3A18%5D(%5BF%3A19%5D)(%5BF%3A21%5D)%5BF%3A20%5D)%3D%5BCH%3A11%5D%5BC%3A10%5D%3D2%5BCl%3A9%5D)%5BCH%3A3%5D%3D1&w=100&h=80)
![[Cl:5][C:6]1[CH:7]=[C:8]([C:12]2[C:13]([Cl:23])=[CH:14][C:15]([C:19]([F:22])([F:20])[F:21])=[CH:16][C:17]=2[Cl:18])[CH:9]=[CH:10][C:11]=1[N+:1]([O-:4])=[O:2]](/api/mol/svg?smiles=%5BCl%3A5%5D%5BC%3A6%5D1%5BCH%3A7%5D%3D%5BC%3A8%5D(%5BC%3A12%5D2%5BC%3A13%5D(%5BCl%3A23%5D)%3D%5BCH%3A14%5D%5BC%3A15%5D(%5BC%3A19%5D(%5BF%3A22%5D)(%5BF%3A20%5D)%5BF%3A21%5D)%3D%5BCH%3A16%5D%5BC%3A17%5D%3D2%5BCl%3A18%5D)%5BCH%3A9%5D%3D%5BCH%3A10%5D%5BC%3A11%5D%3D1%5BN%2B%3A1%5D(%5BO-%3A4%5D)%3D%5BO%3A2%5D&w=100&h=80)
![[F:21][C:15]1[CH:14]=[C:13]([C:3]2[CH:4]=[CH:5][C:6]([Cl:8])=[CH:7][C:2]=2[Cl:1])[CH:20]=[CH:19][C:16]=1[C:17]#[N:18]](/api/mol/svg?smiles=%5BF%3A21%5D%5BC%3A15%5D1%5BCH%3A14%5D%3D%5BC%3A13%5D(%5BC%3A3%5D2%5BCH%3A4%5D%3D%5BCH%3A5%5D%5BC%3A6%5D(%5BCl%3A8%5D)%3D%5BCH%3A7%5D%5BC%3A2%5D%3D2%5BCl%3A1%5D)%5BCH%3A20%5D%3D%5BCH%3A19%5D%5BC%3A16%5D%3D1%5BC%3A17%5D%23%5BN%3A18%5D&w=100&h=80)
![[F:1][C:2]1[CH:9]=[C:8]([Br:10])[CH:7]=[CH:6][C:3]=1[CH:4]1[O:13][CH2:12][CH2:11][O:5]1](/api/mol/svg?smiles=%5BF%3A1%5D%5BC%3A2%5D1%5BCH%3A9%5D%3D%5BC%3A8%5D(%5BBr%3A10%5D)%5BCH%3A7%5D%3D%5BCH%3A6%5D%5BC%3A3%5D%3D1%5BCH%3A4%5D1%5BO%3A13%5D%5BCH2%3A12%5D%5BCH2%3A11%5D%5BO%3A5%5D1&w=100&h=80)
![[Cl:10][C:11]1[CH:18]=[C:17]([C:7]2[C:3]([C:2]([F:9])([F:8])[F:1])=[N:4][NH:5][CH:6]=2)[CH:16]=[CH:15][C:12]=1[CH:13]=[O:14]](/api/mol/svg?smiles=%5BCl%3A10%5D%5BC%3A11%5D1%5BCH%3A18%5D%3D%5BC%3A17%5D(%5BC%3A7%5D2%5BC%3A3%5D(%5BC%3A2%5D(%5BF%3A9%5D)(%5BF%3A8%5D)%5BF%3A1%5D)%3D%5BN%3A4%5D%5BNH%3A5%5D%5BCH%3A6%5D%3D2)%5BCH%3A16%5D%3D%5BCH%3A15%5D%5BC%3A12%5D%3D1%5BCH%3A13%5D%3D%5BO%3A14%5D&w=100&h=80)
![[Cl:10][C:11]1[CH:18]=[C:17]([C:7]2[C:3]([C:2]([F:9])([F:8])[F:1])=[N:4][NH:5][CH:6]=2)[CH:16]=[CH:15][C:12]=1[C:13]#[N:14]](/api/mol/svg?smiles=%5BCl%3A10%5D%5BC%3A11%5D1%5BCH%3A18%5D%3D%5BC%3A17%5D(%5BC%3A7%5D2%5BC%3A3%5D(%5BC%3A2%5D(%5BF%3A9%5D)(%5BF%3A8%5D)%5BF%3A1%5D)%3D%5BN%3A4%5D%5BNH%3A5%5D%5BCH%3A6%5D%3D2)%5BCH%3A16%5D%3D%5BCH%3A15%5D%5BC%3A12%5D%3D1%5BC%3A13%5D%23%5BN%3A14%5D&w=100&h=80)
![[Cl:1][C:2]1[CH:7]=[C:6]([Cl:8])[CH:5]=[CH:4][C:3]=1[C:13]1[CH:14]=[C:15]([CH:17]=[CH:18][CH:19]=1)[NH2:16]](/api/mol/svg?smiles=%5BCl%3A1%5D%5BC%3A2%5D1%5BCH%3A7%5D%3D%5BC%3A6%5D(%5BCl%3A8%5D)%5BCH%3A5%5D%3D%5BCH%3A4%5D%5BC%3A3%5D%3D1%5BC%3A13%5D1%5BCH%3A14%5D%3D%5BC%3A15%5D(%5BCH%3A17%5D%3D%5BCH%3A18%5D%5BCH%3A19%5D%3D1)%5BNH2%3A16%5D&w=100&h=80)
Dataset #133
反应 #586138
收率 37.1%DOI: 10.6084/m9.figshare.5104873.v1
反应 #586139
收率 36.0%DOI: 10.6084/m9.figshare.5104873.v1
反应 #586140
收率 19.3%DOI: 10.6084/m9.figshare.5104873.v1
反应 #586141
收率 43.8%DOI: 10.6084/m9.figshare.5104873.v1
反应 #586142
收率 75.4%DOI: 10.6084/m9.figshare.5104873.v1
反应 #586143
收率 51.0%DOI: 10.6084/m9.figshare.5104873.v1
反应 #586144
收率 85.1%DOI: 10.6084/m9.figshare.5104873.v1
反应 #586145
收率 81.1%DOI: 10.6084/m9.figshare.5104873.v1
反应 #586146
收率 75.0%DOI: 10.6084/m9.figshare.5104873.v1
反应 #586147
收率 97.6%DOI: 10.6084/m9.figshare.5104873.v1
反应 #586148
收率 46.4%DOI: 10.6084/m9.figshare.5104873.v1
反应 #586149
收率 85.7%DOI: 10.6084/m9.figshare.5104873.v1
反应 #586150
收率 86.7%DOI: 10.6084/m9.figshare.5104873.v1
反应 #586151
收率 36.7%DOI: 10.6084/m9.figshare.5104873.v1
反应 #586152
收率 52.6%DOI: 10.6084/m9.figshare.5104873.v1
反应 #586153
收率 94.0%DOI: 10.6084/m9.figshare.5104873.v1
反应 #586154
收率 97.0%DOI: 10.6084/m9.figshare.5104873.v1
反应 #586155
收率 550.4%DOI: 10.6084/m9.figshare.5104873.v1
反应 #586156
收率 92.0%DOI: 10.6084/m9.figshare.5104873.v1
反应 #586157
收率 36.3%DOI: 10.6084/m9.figshare.5104873.v1