1-{4-Hydroxy-5-[4-(trifluoromethyl)phenyl]thiophen-3-yl}ethan-1-one → Methyl 2-nitro-4-[(2-{1-[5-(4-trifluoromethylphenyl)-4-hydroxy-3-thienyl]ethylidene}hydrazino) carbonyl]benzoate
반응식
[F:1][C:2]([c:3]1[cH:4][cH:5][c:6](-[c:9]2[s:10][cH:11][c:12]([C:15](=[O:16])[CH3:17])[c:13]2[OH:14])[cH:7][cH:8]1)([F:18])[F:19].[NH:20]([NH2:21])[C:22](=[O:23])[c:24]1[cH:25][c:26]([N+:34](=[O:35])[O-:36])[c:27]([C:28](=[O:29])[O:30][CH3:31])[cH:32][cH:33]1>>[F:1][C:2]([c:3]1[cH:4][cH:5][c:6](-[c:9]2[s:10][cH:11][c:12]([C:15]([CH3:17])=[N:21][NH:20][C:22](=[O:23])[c:24]3[cH:25][c:26]([N+:34](=[O:35])[O-:36])[c:27]([C:28](=[O:29])[O:30][CH3:31])[cH:32][cH:33]3)[c:13]2[OH:14])[cH:7][cH:8]1)([F:18])[F:19]참가 물질
3
출처 및 근거
- ORD 기록
- ord-dc49de66fb754c35b7de4a9880561699
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
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