Isopropylamine → 6-[3-(4-Chloro-phenyl)-isoxazol-4-ylmethoxy]-N-isopropyl-nicotinamide
반응식
[CH3:1][O:2][C:3]([c:4]1[cH:5][n:6][c:7]([O:10][CH2:11][c:12]2[c:13](-[c:17]3[cH:18][cH:19][c:20]([Cl:23])[cH:21][cH:22]3)[n:14][o:15][cH:16]2)[cH:8][cH:9]1)=[O:24].[CH3:25][CH:26]([CH3:27])[NH2:28]>>[C:3]([c:4]1[cH:5][n:6][c:7]([O:10][CH2:11][c:12]2[c:13](-[c:17]3[cH:18][cH:19][c:20]([Cl:23])[cH:21][cH:22]3)[n:14][o:15][cH:16]2)[cH:8][cH:9]1)(=[O:24])[NH:28][CH:26]([CH3:25])[CH3:27]참가 물질
3
출처 및 근거
- ORD 기록
- ord-d47d69765d304964b7092df5495d06b6
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
반응 노트
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