Pyridine → N-[3-({2-[(cyclopropylcarbonyl)amino]-1,3-benzooxazol-6-yl}oxy)phenyl]-3-(trifluoromethyl)benzamide
반응식
[CH3:43][N:44]([CH3:45])[c:46]1[cH:47][cH:48][n:49][cH:50][cH:51]1.[F:24][C:25]([c:26]1[cH:27][c:28]([C:29](=[O:30])[Cl:31])[cH:32][cH:33][cH:34]1)([F:35])[F:36].[NH2:1][c:2]1[cH:3][c:4]([O:5][c:6]2[cH:7][c:8]3[c:9]([n:10][c:11]([NH:13][C:14](=[O:15])[CH:16]4[CH2:17][CH2:18]4)[o:12]3)[cH:19][cH:20]2)[cH:21][cH:22][cH:23]1.[cH:37]1[cH:38][cH:39][n:40][cH:41][cH:42]1>>[NH:1]([c:2]1[cH:3][c:4]([O:5][c:6]2[cH:7][c:8]3[c:9]([n:10][c:11]([NH:13][C:14](=[O:15])[CH:16]4[CH2:17][CH2:18]4)[o:12]3)[cH:19][cH:20]2)[cH:21][cH:22][cH:23]1)[C:29]([c:28]1[cH:27][c:26]([C:25]([F:24])([F:35])[F:36])[cH:34][cH:33][cH:32]1)=[O:30]참가 물질
5
출처 및 근거
- ORD 기록
- ord-e697ecfc7f144d3689b71e694161bb95
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
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