← Browse datasets![[CH3:18][O:5][C:4](=[O:6])[C:3]1[CH:7]=[C:8]([Cl:12])[CH:9]=[C:10]([Cl:11])[C:2]=1[NH2:1]](/api/mol/svg?smiles=%5BCH3%3A18%5D%5BO%3A5%5D%5BC%3A4%5D(%3D%5BO%3A6%5D)%5BC%3A3%5D1%5BCH%3A7%5D%3D%5BC%3A8%5D(%5BCl%3A12%5D)%5BCH%3A9%5D%3D%5BC%3A10%5D(%5BCl%3A11%5D)%5BC%3A2%5D%3D1%5BNH2%3A1%5D&w=100&h=80)
[C:4]1[CH:9]=[C:8]([Cl:10])[CH:7]=[C:6]([Cl:11])[C:5]=1[NH2:12])([CH3:17])([CH3:16])[CH3:15]](/api/mol/svg?smiles=%5BC%3A14%5D(%5BNH%3A18%5D%5BC%3A3%5D(%3D%5BO%3A13%5D)%5BC%3A4%5D1%5BCH%3A9%5D%3D%5BC%3A8%5D(%5BCl%3A10%5D)%5BCH%3A7%5D%3D%5BC%3A6%5D(%5BCl%3A11%5D)%5BC%3A5%5D%3D1%5BNH2%3A12%5D)(%5BCH3%3A17%5D)(%5BCH3%3A16%5D)%5BCH3%3A15%5D&w=100&h=80)
[C:4]1[CH:9]=[C:8]([Br:10])[CH:7]=[C:6]([CH3:11])[C:5]=1[NH2:12])[CH2:20][CH3:21])[CH3:15]](/api/mol/svg?smiles=%5BCH2%3A14%5D(%5BN%3A16%5D(%5BCH2%3A17%5D%5BCH2%3A18%5D%5BNH%3A19%5D%5BC%3A3%5D(%3D%5BO%3A13%5D)%5BC%3A4%5D1%5BCH%3A9%5D%3D%5BC%3A8%5D(%5BBr%3A10%5D)%5BCH%3A7%5D%3D%5BC%3A6%5D(%5BCH3%3A11%5D)%5BC%3A5%5D%3D1%5BNH2%3A12%5D)%5BCH2%3A20%5D%5BCH3%3A21%5D)%5BCH3%3A15%5D&w=100&h=80)
![[CH3:13][O:5][C:4](=[O:6])[C:3]1[CH:7]=[C:8]([Cl:12])[CH:9]=[C:10]([CH3:11])[C:2]=1[NH2:1]](/api/mol/svg?smiles=%5BCH3%3A13%5D%5BO%3A5%5D%5BC%3A4%5D(%3D%5BO%3A6%5D)%5BC%3A3%5D1%5BCH%3A7%5D%3D%5BC%3A8%5D(%5BCl%3A12%5D)%5BCH%3A9%5D%3D%5BC%3A10%5D(%5BCH3%3A11%5D)%5BC%3A2%5D%3D1%5BNH2%3A1%5D&w=100&h=80)
![[OH:15][CH2:14][CH2:16][NH:17][C:3](=[O:13])[C:4]1[CH:9]=[C:8]([Cl:10])[CH:7]=[C:6]([CH3:11])[C:5]=1[NH2:12]](/api/mol/svg?smiles=%5BOH%3A15%5D%5BCH2%3A14%5D%5BCH2%3A16%5D%5BNH%3A17%5D%5BC%3A3%5D(%3D%5BO%3A13%5D)%5BC%3A4%5D1%5BCH%3A9%5D%3D%5BC%3A8%5D(%5BCl%3A10%5D)%5BCH%3A7%5D%3D%5BC%3A6%5D(%5BCH3%3A11%5D)%5BC%3A5%5D%3D1%5BNH2%3A12%5D&w=100&h=80)
![[F:15][C:16]([F:21])([F:20])[C:17]([N:1]=[C:2]1[CH:7]=[CH:6][CH:5]=[CH:4][NH:3]1)=[O:18]](/api/mol/svg?smiles=%5BF%3A15%5D%5BC%3A16%5D(%5BF%3A21%5D)(%5BF%3A20%5D)%5BC%3A17%5D(%5BN%3A1%5D%3D%5BC%3A2%5D1%5BCH%3A7%5D%3D%5BCH%3A6%5D%5BCH%3A5%5D%3D%5BCH%3A4%5D%5BNH%3A3%5D1)%3D%5BO%3A18%5D&w=100&h=80)
![[ClH:1]](/api/mol/svg?smiles=%5BClH%3A1%5D&w=100&h=80)
![[Br:29][CH:30]([Br:34])[C:31]([N:16]=[C:11]1[CH:12]=[CH:13][CH:14]=[CH:15][N:10]1[CH2:9][C:6]1[CH:7]=[N:8][C:3]([Cl:2])=[CH:4][CH:5]=1)=[O:32]](/api/mol/svg?smiles=%5BBr%3A29%5D%5BCH%3A30%5D(%5BBr%3A34%5D)%5BC%3A31%5D(%5BN%3A16%5D%3D%5BC%3A11%5D1%5BCH%3A12%5D%3D%5BCH%3A13%5D%5BCH%3A14%5D%3D%5BCH%3A15%5D%5BN%3A10%5D1%5BCH2%3A9%5D%5BC%3A6%5D1%5BCH%3A7%5D%3D%5BN%3A8%5D%5BC%3A3%5D(%5BCl%3A2%5D)%3D%5BCH%3A4%5D%5BCH%3A5%5D%3D1)%3D%5BO%3A32%5D&w=100&h=80)
![[Br:10][CH2:9][C:5]1[CH:6]=[C:7]([F:8])[C:2]([Cl:1])=[N:3][CH:4]=1](/api/mol/svg?smiles=%5BBr%3A10%5D%5BCH2%3A9%5D%5BC%3A5%5D1%5BCH%3A6%5D%3D%5BC%3A7%5D(%5BF%3A8%5D)%5BC%3A2%5D(%5BCl%3A1%5D)%3D%5BN%3A3%5D%5BCH%3A4%5D%3D1&w=100&h=80)
![[Br:9][CH2:8][C:5]1[CH:6]=[CH:7][C:2]([F:1])=[N:3][CH:4]=1](/api/mol/svg?smiles=%5BBr%3A9%5D%5BCH2%3A8%5D%5BC%3A5%5D1%5BCH%3A6%5D%3D%5BCH%3A7%5D%5BC%3A2%5D(%5BF%3A1%5D)%3D%5BN%3A3%5D%5BCH%3A4%5D%3D1&w=100&h=80)
![[F:9][C:6]1[N:7]=[CH:8][C:3]([CH2:2][N:16]2[CH:17]=[CH:18][CH:19]=[CH:20][C:15]2=[N:14][C:12](=[O:13])[C:11]([F:21])([F:22])[F:10])=[CH:4][CH:5]=1](/api/mol/svg?smiles=%5BF%3A9%5D%5BC%3A6%5D1%5BN%3A7%5D%3D%5BCH%3A8%5D%5BC%3A3%5D(%5BCH2%3A2%5D%5BN%3A16%5D2%5BCH%3A17%5D%3D%5BCH%3A18%5D%5BCH%3A19%5D%3D%5BCH%3A20%5D%5BC%3A15%5D2%3D%5BN%3A14%5D%5BC%3A12%5D(%3D%5BO%3A13%5D)%5BC%3A11%5D(%5BF%3A21%5D)(%5BF%3A22%5D)%5BF%3A10%5D)%3D%5BCH%3A4%5D%5BCH%3A5%5D%3D1&w=100&h=80)
![[Br:1][C:2]1[CH:7]=[CH:6][C:5]([CH2:8][Br:9])=[CH:4][N:3]=1](/api/mol/svg?smiles=%5BBr%3A1%5D%5BC%3A2%5D1%5BCH%3A7%5D%3D%5BCH%3A6%5D%5BC%3A5%5D(%5BCH2%3A8%5D%5BBr%3A9%5D)%3D%5BCH%3A4%5D%5BN%3A3%5D%3D1&w=100&h=80)
![[Br:1][C:2]1[N:3]=[CH:4][C:5]([CH2:8][N:16]2[CH:17]=[CH:18][CH:19]=[CH:20][C:15]2=[N:14][C:12](=[O:13])[C:11]([F:21])([F:22])[F:10])=[CH:6][CH:7]=1](/api/mol/svg?smiles=%5BBr%3A1%5D%5BC%3A2%5D1%5BN%3A3%5D%3D%5BCH%3A4%5D%5BC%3A5%5D(%5BCH2%3A8%5D%5BN%3A16%5D2%5BCH%3A17%5D%3D%5BCH%3A18%5D%5BCH%3A19%5D%3D%5BCH%3A20%5D%5BC%3A15%5D2%3D%5BN%3A14%5D%5BC%3A12%5D(%3D%5BO%3A13%5D)%5BC%3A11%5D(%5BF%3A21%5D)(%5BF%3A22%5D)%5BF%3A10%5D)%3D%5BCH%3A6%5D%5BCH%3A7%5D%3D1&w=100&h=80)
![[Cl:17][CH2:18][C:19]([N:16]=[C:11]1[CH:12]=[CH:13][CH:14]=[CH:15][N:10]1[CH2:9][C:6]1[CH:7]=[N:8][C:3]([Cl:2])=[CH:4][CH:5]=1)=[O:20]](/api/mol/svg?smiles=%5BCl%3A17%5D%5BCH2%3A18%5D%5BC%3A19%5D(%5BN%3A16%5D%3D%5BC%3A11%5D1%5BCH%3A12%5D%3D%5BCH%3A13%5D%5BCH%3A14%5D%3D%5BCH%3A15%5D%5BN%3A10%5D1%5BCH2%3A9%5D%5BC%3A6%5D1%5BCH%3A7%5D%3D%5BN%3A8%5D%5BC%3A3%5D(%5BCl%3A2%5D)%3D%5BCH%3A4%5D%5BCH%3A5%5D%3D1)%3D%5BO%3A20%5D&w=100&h=80)
![[F:8][CH:9]([F:13])[C:10]([N:1]=[C:2]1[CH:7]=[CH:6][CH:5]=[CH:4][NH:3]1)=[O:11]](/api/mol/svg?smiles=%5BF%3A8%5D%5BCH%3A9%5D(%5BF%3A13%5D)%5BC%3A10%5D(%5BN%3A1%5D%3D%5BC%3A2%5D1%5BCH%3A7%5D%3D%5BCH%3A6%5D%5BCH%3A5%5D%3D%5BCH%3A4%5D%5BNH%3A3%5D1)%3D%5BO%3A11%5D&w=100&h=80)
![[Cl:13][C:14]1[N:15]=[CH:16][C:17]([CH2:20][N:7]2[CH:8]=[CH:9][CH:10]=[CH:11][C:6]2=[N:5][C:3](=[O:4])[CH:2]([F:1])[F:12])=[CH:18][CH:19]=1](/api/mol/svg?smiles=%5BCl%3A13%5D%5BC%3A14%5D1%5BN%3A15%5D%3D%5BCH%3A16%5D%5BC%3A17%5D(%5BCH2%3A20%5D%5BN%3A7%5D2%5BCH%3A8%5D%3D%5BCH%3A9%5D%5BCH%3A10%5D%3D%5BCH%3A11%5D%5BC%3A6%5D2%3D%5BN%3A5%5D%5BC%3A3%5D(%3D%5BO%3A4%5D)%5BCH%3A2%5D(%5BF%3A1%5D)%5BF%3A12%5D)%3D%5BCH%3A18%5D%5BCH%3A19%5D%3D1&w=100&h=80)
![[Cl:20][C:21]([F:26])([F:25])[C:22]([N:1]=[C:2]1[CH:7]=[CH:6][CH:5]=[CH:4][NH:3]1)=[O:23]](/api/mol/svg?smiles=%5BCl%3A20%5D%5BC%3A21%5D(%5BF%3A26%5D)(%5BF%3A25%5D)%5BC%3A22%5D(%5BN%3A1%5D%3D%5BC%3A2%5D1%5BCH%3A7%5D%3D%5BCH%3A6%5D%5BCH%3A5%5D%3D%5BCH%3A4%5D%5BNH%3A3%5D1)%3D%5BO%3A23%5D&w=100&h=80)
![[Cl:10][C:11]([F:21])([F:22])[C:12]([N:14]=[C:15]1[CH:20]=[CH:19][CH:18]=[CH:17][N:16]1[CH2:8][C:5]1[CH:4]=[N:3][C:2]([Cl:1])=[CH:7][CH:6]=1)=[O:13]](/api/mol/svg?smiles=%5BCl%3A10%5D%5BC%3A11%5D(%5BF%3A21%5D)(%5BF%3A22%5D)%5BC%3A12%5D(%5BN%3A14%5D%3D%5BC%3A15%5D1%5BCH%3A20%5D%3D%5BCH%3A19%5D%5BCH%3A18%5D%3D%5BCH%3A17%5D%5BN%3A16%5D1%5BCH2%3A8%5D%5BC%3A5%5D1%5BCH%3A4%5D%3D%5BN%3A3%5D%5BC%3A2%5D(%5BCl%3A1%5D)%3D%5BCH%3A7%5D%5BCH%3A6%5D%3D1)%3D%5BO%3A13%5D&w=100&h=80)
![[Cl:24][C:25]([Cl:30])([Cl:29])[C:26]([N:16]=[C:11]1[CH:12]=[CH:13][CH:14]=[CH:15][N:10]1[CH2:9][C:6]1[CH:7]=[N:8][C:3]([Cl:2])=[CH:4][CH:5]=1)=[O:27]](/api/mol/svg?smiles=%5BCl%3A24%5D%5BC%3A25%5D(%5BCl%3A30%5D)(%5BCl%3A29%5D)%5BC%3A26%5D(%5BN%3A16%5D%3D%5BC%3A11%5D1%5BCH%3A12%5D%3D%5BCH%3A13%5D%5BCH%3A14%5D%3D%5BCH%3A15%5D%5BN%3A10%5D1%5BCH2%3A9%5D%5BC%3A6%5D1%5BCH%3A7%5D%3D%5BN%3A8%5D%5BC%3A3%5D(%5BCl%3A2%5D)%3D%5BCH%3A4%5D%5BCH%3A5%5D%3D1)%3D%5BO%3A27%5D&w=100&h=80)
![[F:26][C:22]([F:27])([C:21]([F:29])([F:28])[F:20])[C:23]([N:1]=[C:2]1[CH:7]=[CH:6][CH:5]=[CH:4][NH:3]1)=[O:24]](/api/mol/svg?smiles=%5BF%3A26%5D%5BC%3A22%5D(%5BF%3A27%5D)(%5BC%3A21%5D(%5BF%3A29%5D)(%5BF%3A28%5D)%5BF%3A20%5D)%5BC%3A23%5D(%5BN%3A1%5D%3D%5BC%3A2%5D1%5BCH%3A7%5D%3D%5BCH%3A6%5D%5BCH%3A5%5D%3D%5BCH%3A4%5D%5BNH%3A3%5D1)%3D%5BO%3A24%5D&w=100&h=80)
Dataset #159
Reaction #710459
Yield 78.6%DOI: 10.6084/m9.figshare.5104873.v1
Reaction #710460
Yield 90.4%DOI: 10.6084/m9.figshare.5104873.v1
Reaction #710461
Yield 84.2%DOI: 10.6084/m9.figshare.5104873.v1
Reaction #710462
Yield 1218.4%DOI: 10.6084/m9.figshare.5104873.v1
Reaction #710463
Yield 88.4%DOI: 10.6084/m9.figshare.5104873.v1
Reaction #710464
Yield 71.0%DOI: 10.6084/m9.figshare.5104873.v1
Reaction #710465
Yield 86.9%DOI: 10.6084/m9.figshare.5104873.v1
Reaction #710466
Yield 15.0%DOI: 10.6084/m9.figshare.5104873.v1
Reaction #710467
Yield 51.0%DOI: 10.6084/m9.figshare.5104873.v1
Reaction #710468
Yield 35.1%DOI: 10.6084/m9.figshare.5104873.v1
Reaction #710469
DOI: 10.6084/m9.figshare.5104873.v1
Reaction #710470
Yield 20.0%DOI: 10.6084/m9.figshare.5104873.v1
Reaction #710471
DOI: 10.6084/m9.figshare.5104873.v1
Reaction #710472
Yield 5.0%DOI: 10.6084/m9.figshare.5104873.v1
Reaction #710473
Yield 14.0%DOI: 10.6084/m9.figshare.5104873.v1
Reaction #710474
DOI: 10.6084/m9.figshare.5104873.v1
Reaction #710475
Yield 24.0%DOI: 10.6084/m9.figshare.5104873.v1
Reaction #710476
DOI: 10.6084/m9.figshare.5104873.v1
Reaction #710477
Yield 62.0%DOI: 10.6084/m9.figshare.5104873.v1
Reaction #710478
Yield 11.1%DOI: 10.6084/m9.figshare.5104873.v1
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