Trifluoroacetic acid → 2-[7,8-Difluoro-3-(1H-indazol-3-ylmethyl)-2,4-dioxo-5-phenyl-2,3,4,5-tetrahydro-benzo[b][1,4]diazepin-1-yl]-N-isopropyl-N-(4-methoxy-phenyl)-acetamide
반응식
[F:8][c:9]1[cH:10][c:11]2[c:12]([cH:58][c:59]1[F:60])[N:13]([CH2:43][C:44](=[O:45])[N:46]([c:47]1[cH:48][cH:49][c:50]([O:53][CH3:54])[cH:51][cH:52]1)[CH:55]([CH3:56])[CH3:57])[C:14](=[O:42])[CH:15]([CH2:25][c:26]1[n:27][n:28]([C:35]([O:36][C:37]([CH3:38])([CH3:39])[CH3:40])=[O:41])[c:29]3[cH:30][cH:31][cH:32][cH:33][c:34]13)[C:16](=[O:24])[N:17]2[c:18]1[cH:19][cH:20][cH:21][cH:22][cH:23]1.[OH:1][C:2]([C:3]([F:4])([F:5])[F:6])=[O:7]>>[F:8][c:9]1[cH:10][c:11]2[c:12]([cH:58][c:59]1[F:60])[N:13]([CH2:43][C:44](=[O:45])[N:46]([c:47]1[cH:48][cH:49][c:50]([O:53][CH3:54])[cH:51][cH:52]1)[CH:55]([CH3:56])[CH3:57])[C:14](=[O:42])[CH:15]([CH2:25][c:26]1[n:27][nH:28][c:29]3[cH:30][cH:31][cH:32][cH:33][c:34]13)[C:16](=[O:24])[N:17]2[c:18]1[cH:19][cH:20][cH:21][cH:22][cH:23]1참가 물질
3
반응물 2
생성물 1
출처 및 근거
- ORD 기록
- ord-486bf4a920d140c48fb1d2833dec6b2c
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)