Hydrochloric Acid → 5-chloro-N-(4-oxo-3,5-dihydro-2H-1,5-benzoxazepin-3-yl)-1H-indole-2-carboxamide
반응식
[CH3:39][N:40]([CH3:41])[CH2:42][CH2:43][CH2:44][N:45]=[C:46]=[N:47][CH2:48][CH3:49].[CH:50]([N:51]([CH:52]([CH3:53])[CH3:54])[CH2:55][CH3:56])([CH3:57])[CH3:58].[Cl:15][c:16]1[cH:17][c:18]2[cH:19][c:20]([C:25](=[O:26])[OH:27])[nH:21][c:22]2[cH:23][cH:24]1.[ClH:1].[ClH:38].[NH2:2][CH:3]1[CH2:4][O:5][c:6]2[c:7]([cH:11][cH:12][cH:13][cH:14]2)[NH:8][C:9]1=[O:10].[O:59]1[CH2:60][CH2:61][CH2:62][CH2:63]1.[OH:28][n:29]1[c:30]2[n:31][cH:32][cH:33][cH:34][c:35]2[n:36][n:37]1>>[NH:2]([CH:3]1[CH2:4][O:5][c:6]2[c:7]([cH:11][cH:12][cH:13][cH:14]2)[NH:8][C:9]1=[O:10])[C:25]([c:20]1[cH:19][c:18]2[cH:17][c:16]([Cl:15])[cH:24][cH:23][c:22]2[nH:21]1)=[O:26]참가 물질
8
반응물 7
생성물 1
출처 및 근거
- ORD 기록
- ord-ecfdeebbd7864cacb03ee6e4e975c724
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
반응 노트
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