Triethylamine → N-[4-((6,11-Dihydro-5H-dibenz[b,e]azepin-5-yl)carbonyl]phenyl]-2-trifluoromethylbenzamide
반응식
[CH3:38][CH2:39][N:40]([CH2:41][CH3:42])[CH2:43][CH3:44].[F:25][C:26]([c:27]1[c:28]([C:29](=[O:30])[Cl:31])[cH:32][cH:33][cH:34][cH:35]1)([F:36])[F:37].[NH2:1][c:2]1[cH:3][cH:4][c:5]([C:6](=[O:7])[N:8]2[c:9]3[c:10]([cH:19][cH:20][cH:21][cH:22]3)[CH2:11][c:12]3[c:13]([cH:15][cH:16][cH:17][cH:18]3)[CH2:14]2)[cH:23][cH:24]1>>[NH:1]([c:2]1[cH:3][cH:4][c:5]([C:6](=[O:7])[N:8]2[c:9]3[c:10]([cH:19][cH:20][cH:21][cH:22]3)[CH2:11][c:12]3[c:13]([cH:15][cH:16][cH:17][cH:18]3)[CH2:14]2)[cH:23][cH:24]1)[C:29]([c:28]1[c:27]([C:26]([F:25])([F:36])[F:37])[cH:35][cH:34][cH:33][cH:32]1)=[O:30]참가 물질
4
출처 및 근거
- ORD 기록
- ord-cfd72b31ec284c3e86aed2321576a66d
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
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