Dimethyl Sulfoxide → (5-Isobutylamino-2-nitro-4-trifluoromethyl-phenyl)-carbamic acid tert-butyl ester
반응식
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][c:8]1[c:9]([N+:19](=[O:20])[O-:21])[cH:10][c:11]([C:15]([F:16])([F:17])[F:18])[c:12]([Cl:14])[cH:13]1)=[O:22].[CH2:23]([CH:24]([CH3:25])[CH3:26])[NH2:27].[CH3:28][S:29]([CH3:30])=[O:31]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][c:8]1[c:9]([N+:19](=[O:20])[O-:21])[cH:10][c:11]([C:15]([F:16])([F:17])[F:18])[c:12]([NH:27][CH2:23][CH:24]([CH3:25])[CH3:26])[cH:13]1)=[O:22]참가 물질
4
출처 및 근거
- ORD 기록
- ord-e373b5974245455d9ef98ecd499b4336
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
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