N-((3-methoxyphenyl)methyl)cyclopropanamine → 2-((4-tert-Butyl-benzenesulfonyl)-{[cyclopropyl-(3-methoxy-benzyl)-carbamoyl]-methyl}-amino)-benzamide
반응식
[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][cH:7][c:8]([S:11](=[O:12])(=[O:13])[N:14]([c:15]2[c:16]([C:21]([NH2:22])=[O:23])[cH:17][cH:18][cH:19][cH:20]2)[CH2:24][C:25](=[O:26])[OH:27])[cH:9][cH:10]1.[CH:28]1([NH:31][CH2:32][c:33]2[cH:34][c:35]([O:39][CH3:40])[cH:36][cH:37][cH:38]2)[CH2:29][CH2:30]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][cH:7][c:8]([S:11](=[O:12])(=[O:13])[N:14]([c:15]2[c:16]([C:21]([NH2:22])=[O:23])[cH:17][cH:18][cH:19][cH:20]2)[CH2:24][C:25](=[O:26])[N:31]([CH:28]2[CH2:29][CH2:30]2)[CH2:32][c:33]2[cH:34][c:35]([O:39][CH3:40])[cH:36][cH:37][cH:38]2)[cH:9][cH:10]1참가 물질
3
출처 및 근거
- ORD 기록
- ord-9c38aafd969c45ecb39ddce953045541
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
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