← 浏览数据集![[NH2:20][C:17]1[S:18][CH:19]=[C:15]([CH2:14][O:1]/[N:2]=[C:3](/[C:6]2[CH:11]=[CH:10][CH:9]=[CH:8][CH:7]=2)\[C:4]#[N:5])[N:16]=1](/api/mol/svg?smiles=%5BNH2%3A20%5D%5BC%3A17%5D1%5BS%3A18%5D%5BCH%3A19%5D%3D%5BC%3A15%5D(%5BCH2%3A14%5D%5BO%3A1%5D%2F%5BN%3A2%5D%3D%5BC%3A3%5D(%2F%5BC%3A6%5D2%5BCH%3A11%5D%3D%5BCH%3A10%5D%5BCH%3A9%5D%3D%5BCH%3A8%5D%5BCH%3A7%5D%3D2)%5C%5BC%3A4%5D%23%5BN%3A5%5D)%5BN%3A16%5D%3D1&w=100&h=80)
[O:33][CH2:32][CH2:31][C:25]2[CH:30]=[CH:29][CH:28]=[CH:27][CH:26]=2)[S:3][CH:4]=1)/[C:13]1[CH:18]=[CH:17][CH:16]=[CH:15][CH:14]=1)#[N:12]](/api/mol/svg?smiles=%5BC%3A11%5D(%2F%5BC%3A10%5D(%3D%5BN%3A9%5D%5C%5BO%3A8%5D%5BCH2%3A7%5D%5BC%3A5%5D1%5BN%3A6%5D%3D%5BC%3A2%5D(%5BNH%3A1%5D%5BC%3A34%5D(%3D%5BO%3A35%5D)%5BO%3A33%5D%5BCH2%3A32%5D%5BCH2%3A31%5D%5BC%3A25%5D2%5BCH%3A30%5D%3D%5BCH%3A29%5D%5BCH%3A28%5D%3D%5BCH%3A27%5D%5BCH%3A26%5D%3D2)%5BS%3A3%5D%5BCH%3A4%5D%3D1)%2F%5BC%3A13%5D1%5BCH%3A18%5D%3D%5BCH%3A17%5D%5BCH%3A16%5D%3D%5BCH%3A15%5D%5BCH%3A14%5D%3D1)%23%5BN%3A12%5D&w=100&h=80)
![[NH2:20][C:17]1[S:18][CH:19]=[C:15]([CH2:14][O:13]/[N:12]=[C:5](/[C:6]2[CH:7]=[CH:8][CH:9]=[CH:10][CH:11]=2)\[C:4]2[N:3]([CH2:1][CH3:2])[O:34][C:35](=[O:36])[N:32]=2)[N:16]=1](/api/mol/svg?smiles=%5BNH2%3A20%5D%5BC%3A17%5D1%5BS%3A18%5D%5BCH%3A19%5D%3D%5BC%3A15%5D(%5BCH2%3A14%5D%5BO%3A13%5D%2F%5BN%3A12%5D%3D%5BC%3A5%5D(%2F%5BC%3A6%5D2%5BCH%3A7%5D%3D%5BCH%3A8%5D%5BCH%3A9%5D%3D%5BCH%3A10%5D%5BCH%3A11%5D%3D2)%5C%5BC%3A4%5D2%5BN%3A3%5D(%5BCH2%3A1%5D%5BCH3%3A2%5D)%5BO%3A34%5D%5BC%3A35%5D(%3D%5BO%3A36%5D)%5BN%3A32%5D%3D2)%5BN%3A16%5D%3D1&w=100&h=80)
![[F:1][C:2]1[CH:3]=[C:4]([CH:9]([OH:11])[CH3:10])[CH:5]=[C:6]([F:8])[CH:7]=1](/api/mol/svg?smiles=%5BF%3A1%5D%5BC%3A2%5D1%5BCH%3A3%5D%3D%5BC%3A4%5D(%5BCH%3A9%5D(%5BOH%3A11%5D)%5BCH3%3A10%5D)%5BCH%3A5%5D%3D%5BC%3A6%5D(%5BF%3A8%5D)%5BCH%3A7%5D%3D1&w=100&h=80)
![[F:1][C:2]1[CH:3]=[C:4]([C@@H:9]([OH:11])[CH3:10])[CH:5]=[C:6]([F:8])[CH:7]=1](/api/mol/svg?smiles=%5BF%3A1%5D%5BC%3A2%5D1%5BCH%3A3%5D%3D%5BC%3A4%5D(%5BC%40%40H%3A9%5D(%5BOH%3A11%5D)%5BCH3%3A10%5D)%5BCH%3A5%5D%3D%5BC%3A6%5D(%5BF%3A8%5D)%5BCH%3A7%5D%3D1&w=100&h=80)
![[Br:1][C:2]1[CH:7]=[C:6]([NH2:8])[C:5]([CH3:11])=[N:4][C:3]=1[O:12][C@H:13]1[CH2:14][CH2:15][C@@H:16]([CH:19]([CH3:20])[CH3:21])[CH2:17][CH2:18]1](/api/mol/svg?smiles=%5BBr%3A1%5D%5BC%3A2%5D1%5BCH%3A7%5D%3D%5BC%3A6%5D(%5BNH2%3A8%5D)%5BC%3A5%5D(%5BCH3%3A11%5D)%3D%5BN%3A4%5D%5BC%3A3%5D%3D1%5BO%3A12%5D%5BC%40H%3A13%5D1%5BCH2%3A14%5D%5BCH2%3A15%5D%5BC%40%40H%3A16%5D(%5BCH%3A19%5D(%5BCH3%3A20%5D)%5BCH3%3A21%5D)%5BCH2%3A17%5D%5BCH2%3A18%5D1&w=100&h=80)
![[Br:12][C:13]1[CH:14]=[C:15]([N:30]=[CH:1][N:2]([CH2:3][CH3:32])[CH3:5])[C:16]([CH3:29])=[N:17][C:18]=1[O:19][C@H:20]1[CH2:21][CH2:22][C@@H:23]([CH:26]([CH3:27])[CH3:28])[CH2:24][CH2:25]1](/api/mol/svg?smiles=%5BBr%3A12%5D%5BC%3A13%5D1%5BCH%3A14%5D%3D%5BC%3A15%5D(%5BN%3A30%5D%3D%5BCH%3A1%5D%5BN%3A2%5D(%5BCH2%3A3%5D%5BCH3%3A32%5D)%5BCH3%3A5%5D)%5BC%3A16%5D(%5BCH3%3A29%5D)%3D%5BN%3A17%5D%5BC%3A18%5D%3D1%5BO%3A19%5D%5BC%40H%3A20%5D1%5BCH2%3A21%5D%5BCH2%3A22%5D%5BC%40%40H%3A23%5D(%5BCH%3A26%5D(%5BCH3%3A27%5D)%5BCH3%3A28%5D)%5BCH2%3A24%5D%5BCH2%3A25%5D1&w=100&h=80)
![[Br:1][C:2]1[CH:7]=[C:6]([NH2:8])[C:5]([CH3:11])=[N:4][C:3]=1[O:12][C@H:13]1[CH2:14][CH2:15][C@H:16]([CH:19]([CH3:20])[CH3:21])[CH2:17][CH2:18]1](/api/mol/svg?smiles=%5BBr%3A1%5D%5BC%3A2%5D1%5BCH%3A7%5D%3D%5BC%3A6%5D(%5BNH2%3A8%5D)%5BC%3A5%5D(%5BCH3%3A11%5D)%3D%5BN%3A4%5D%5BC%3A3%5D%3D1%5BO%3A12%5D%5BC%40H%3A13%5D1%5BCH2%3A14%5D%5BCH2%3A15%5D%5BC%40H%3A16%5D(%5BCH%3A19%5D(%5BCH3%3A20%5D)%5BCH3%3A21%5D)%5BCH2%3A17%5D%5BCH2%3A18%5D1&w=100&h=80)
![[Br:1][C:2]1[CH:7]=[C:6]([N+:8]([O-:10])=[O:9])[C:5]([CH3:11])=[N:4][C:3]=1[O:12][CH:15]([C:17]1[CH:22]=[CH:21][C:20]([F:23])=[CH:19][CH:18]=1)[C:14]([F:13])([F:25])[F:24]](/api/mol/svg?smiles=%5BBr%3A1%5D%5BC%3A2%5D1%5BCH%3A7%5D%3D%5BC%3A6%5D(%5BN%2B%3A8%5D(%5BO-%3A10%5D)%3D%5BO%3A9%5D)%5BC%3A5%5D(%5BCH3%3A11%5D)%3D%5BN%3A4%5D%5BC%3A3%5D%3D1%5BO%3A12%5D%5BCH%3A15%5D(%5BC%3A17%5D1%5BCH%3A22%5D%3D%5BCH%3A21%5D%5BC%3A20%5D(%5BF%3A23%5D)%3D%5BCH%3A19%5D%5BCH%3A18%5D%3D1)%5BC%3A14%5D(%5BF%3A13%5D)(%5BF%3A25%5D)%5BF%3A24%5D&w=100&h=80)
![[F:1][C:2]([F:15])([F:16])[CH:3]([C:5]1[CH:6]=[CH:7][C:8]([C:11]([F:12])([F:13])[F:14])=[CH:9][CH:10]=1)[OH:4]](/api/mol/svg?smiles=%5BF%3A1%5D%5BC%3A2%5D(%5BF%3A15%5D)(%5BF%3A16%5D)%5BCH%3A3%5D(%5BC%3A5%5D1%5BCH%3A6%5D%3D%5BCH%3A7%5D%5BC%3A8%5D(%5BC%3A11%5D(%5BF%3A12%5D)(%5BF%3A13%5D)%5BF%3A14%5D)%3D%5BCH%3A9%5D%5BCH%3A10%5D%3D1)%5BOH%3A4%5D&w=100&h=80)
![[Br:1][C:2]1[CH:7]=[C:6]([N+:8]([O-:10])=[O:9])[C:5]([CH3:11])=[N:4][C:3]=1[O:12][CH:15]([C:17]1[CH:18]=[CH:19][C:20]([C:23]([F:24])([F:25])[F:26])=[CH:21][CH:22]=1)[C:14]([F:28])([F:27])[F:13]](/api/mol/svg?smiles=%5BBr%3A1%5D%5BC%3A2%5D1%5BCH%3A7%5D%3D%5BC%3A6%5D(%5BN%2B%3A8%5D(%5BO-%3A10%5D)%3D%5BO%3A9%5D)%5BC%3A5%5D(%5BCH3%3A11%5D)%3D%5BN%3A4%5D%5BC%3A3%5D%3D1%5BO%3A12%5D%5BCH%3A15%5D(%5BC%3A17%5D1%5BCH%3A18%5D%3D%5BCH%3A19%5D%5BC%3A20%5D(%5BC%3A23%5D(%5BF%3A24%5D)(%5BF%3A25%5D)%5BF%3A26%5D)%3D%5BCH%3A21%5D%5BCH%3A22%5D%3D1)%5BC%3A14%5D(%5BF%3A28%5D)(%5BF%3A27%5D)%5BF%3A13%5D&w=100&h=80)
![[F:11][C:10]([F:13])([F:12])[CH:1]([OH:7])[CH2:2][CH2:3][CH2:4][CH:5]=[CH2:6]](/api/mol/svg?smiles=%5BF%3A11%5D%5BC%3A10%5D(%5BF%3A13%5D)(%5BF%3A12%5D)%5BCH%3A1%5D(%5BOH%3A7%5D)%5BCH2%3A2%5D%5BCH2%3A3%5D%5BCH2%3A4%5D%5BCH%3A5%5D%3D%5BCH2%3A6%5D&w=100&h=80)
![[S:18]1[CH2:17][CH2:16][C@@H:20]([CH2:21][CH2:22][CH2:23][CH2:24][C:25]([O:27][CH2:31][CH2:30][N:29]([CH3:33])[CH3:28])=[O:26])[S:19]1](/api/mol/svg?smiles=%5BS%3A18%5D1%5BCH2%3A17%5D%5BCH2%3A16%5D%5BC%40%40H%3A20%5D(%5BCH2%3A21%5D%5BCH2%3A22%5D%5BCH2%3A23%5D%5BCH2%3A24%5D%5BC%3A25%5D(%5BO%3A27%5D%5BCH2%3A31%5D%5BCH2%3A30%5D%5BN%3A29%5D(%5BCH3%3A33%5D)%5BCH3%3A28%5D)%3D%5BO%3A26%5D)%5BS%3A19%5D1&w=100&h=80)
=[CH:9][CH:8]=[CH:7][CH:6]=2)([O-:18])=[O:17]](/api/mol/svg?smiles=%5BN%2B%3A16%5D(%5BC%3A12%5D1%5BCH%3A13%5D%3D%5BN%3A5%5D%5BC%3A4%5D2%5BC%3A3%5D(%5BC%3A2%5D%3D1%5BOH%3A11%5D)%3D%5BCH%3A9%5D%5BCH%3A8%5D%3D%5BCH%3A7%5D%5BCH%3A6%5D%3D2)(%5BO-%3A18%5D)%3D%5BO%3A17%5D&w=100&h=80)
=[CH:11][CH:10]=[CH:9][CH:8]=2)([O-:3])=[O:2]](/api/mol/svg?smiles=%5BN%2B%3A1%5D(%5BC%3A4%5D1%5BCH%3A5%5D%3D%5BN%3A6%5D%5BC%3A7%5D2%5BC%3A12%5D(%5BC%3A13%5D%3D1%5BCl%3A17%5D)%3D%5BCH%3A11%5D%5BCH%3A10%5D%3D%5BCH%3A9%5D%5BCH%3A8%5D%3D2)(%5BO-%3A3%5D)%3D%5BO%3A2%5D&w=100&h=80)
=[CH:41][CH:40]=[CH:39][CH:38]=2)([O-:33])=[O:32]](/api/mol/svg?smiles=%5BN%2B%3A31%5D(%5BC%3A34%5D1%5BCH%3A35%5D%3D%5BN%3A36%5D%5BC%3A37%5D2%5BC%3A42%5D(%5BC%3A43%5D%3D1%5BCl%3A47%5D)%3D%5BCH%3A41%5D%5BCH%3A40%5D%3D%5BCH%3A39%5D%5BCH%3A38%5D%3D2)(%5BO-%3A33%5D)%3D%5BO%3A32%5D&w=100&h=80)
=[CH:12][CH:11]=[CH:10][CH:9]=2)([O-:4])=[O:3]](/api/mol/svg?smiles=%5BN%2B%3A2%5D(%5BC%3A5%5D1%5BCH%3A6%5D%3D%5BN%3A7%5D%5BC%3A8%5D2%5BC%3A13%5D(%5BC%3A14%5D%3D1%5BNH2%3A1%5D)%3D%5BCH%3A12%5D%5BCH%3A11%5D%3D%5BCH%3A10%5D%5BCH%3A9%5D%3D2)(%5BO-%3A4%5D)%3D%5BO%3A3%5D&w=100&h=80)
![[NH2:1][C:4]1[CH:5]=[N:6][C:7]2[C:12]([C:13]=1[NH2:14])=[CH:11][CH:10]=[CH:9][CH:8]=2](/api/mol/svg?smiles=%5BNH2%3A1%5D%5BC%3A4%5D1%5BCH%3A5%5D%3D%5BN%3A6%5D%5BC%3A7%5D2%5BC%3A12%5D(%5BC%3A13%5D%3D1%5BNH2%3A14%5D)%3D%5BCH%3A11%5D%5BCH%3A10%5D%3D%5BCH%3A9%5D%5BCH%3A8%5D%3D2&w=100&h=80)
![[O:1]1[CH:5]=[CH:4][CH:3]=[C:2]1[N:20]1[C:19]2[C:18]3[CH:17]=[CH:16][CH:15]=[CH:14][C:13]=3[N:12]=[CH:11][C:10]=2[N:9]=[CH:24]1](/api/mol/svg?smiles=%5BO%3A1%5D1%5BCH%3A5%5D%3D%5BCH%3A4%5D%5BCH%3A3%5D%3D%5BC%3A2%5D1%5BN%3A20%5D1%5BC%3A19%5D2%5BC%3A18%5D3%5BCH%3A17%5D%3D%5BCH%3A16%5D%5BCH%3A15%5D%3D%5BCH%3A14%5D%5BC%3A13%5D%3D3%5BN%3A12%5D%3D%5BCH%3A11%5D%5BC%3A10%5D%3D2%5BN%3A9%5D%3D%5BCH%3A24%5D1&w=100&h=80)
![[Cl:10][C:17]1[C:16]2[N:15]=[CH:14][NH:13][C:25]=2[C:24]2[CH:23]=[CH:22][CH:21]=[CH:20][C:19]=2[N:18]=1](/api/mol/svg?smiles=%5BCl%3A10%5D%5BC%3A17%5D1%5BC%3A16%5D2%5BN%3A15%5D%3D%5BCH%3A14%5D%5BNH%3A13%5D%5BC%3A25%5D%3D2%5BC%3A24%5D2%5BCH%3A23%5D%3D%5BCH%3A22%5D%5BCH%3A21%5D%3D%5BCH%3A20%5D%5BC%3A19%5D%3D2%5BN%3A18%5D%3D1&w=100&h=80)
Dataset #135
反应 #607437
收率 80.0%DOI: 10.6084/m9.figshare.5104873.v1
反应 #607438
收率 76.3%DOI: 10.6084/m9.figshare.5104873.v1
反应 #607439
收率 84.4%DOI: 10.6084/m9.figshare.5104873.v1
反应 #607440
收率 99.3%DOI: 10.6084/m9.figshare.5104873.v1
反应 #607441
收率 40.0%DOI: 10.6084/m9.figshare.5104873.v1
反应 #607442
收率 101.5%DOI: 10.6084/m9.figshare.5104873.v1
反应 #607443
收率 81.0%DOI: 10.6084/m9.figshare.5104873.v1
反应 #607444
收率 100.5%DOI: 10.6084/m9.figshare.5104873.v1
反应 #607445
收率 62.5%DOI: 10.6084/m9.figshare.5104873.v1
反应 #607446
收率 105.1%DOI: 10.6084/m9.figshare.5104873.v1
反应 #607447
收率 41.0%DOI: 10.6084/m9.figshare.5104873.v1
反应 #607448
收率 31.0%DOI: 10.6084/m9.figshare.5104873.v1
反应 #607449
收率 79.0%DOI: 10.6084/m9.figshare.5104873.v1
反应 #607450
DOI: 10.6084/m9.figshare.5104873.v1
反应 #607451
DOI: 10.6084/m9.figshare.5104873.v1
反应 #607452
DOI: 10.6084/m9.figshare.5104873.v1
反应 #607453
DOI: 10.6084/m9.figshare.5104873.v1
反应 #607454
DOI: 10.6084/m9.figshare.5104873.v1
反应 #607455
DOI: 10.6084/m9.figshare.5104873.v1
反应 #607456
DOI: 10.6084/m9.figshare.5104873.v1