1-(4-Nitrophenyl)ethanamine → 5-[1-(4-Nitro-phenyl)-ethylcarbamoyl]-thiophene-2-carboxylic acid methyl ester
반응식
[CH3:13][O:14][C:15](=[O:16])[c:17]1[s:18][c:19]([C:22](=[O:23])[OH:24])[cH:20][cH:21]1.[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][cH:6][c:7]([CH:10]([CH3:11])[NH2:12])[cH:8][cH:9]1>>[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][cH:6][c:7]([CH:10]([CH3:11])[NH:12][C:22]([c:19]2[s:18][c:17]([C:15]([O:14][CH3:13])=[O:16])[cH:21][cH:20]2)=[O:23])[cH:8][cH:9]1참가 물질
3
출처 및 근거
- ORD 기록
- ord-2890d07017744f1687dc22ced78d3ed2
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
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