Hydrochloric Acid → 2-isoquinolin-3-yl-1H-benzoimidazole-4-carboxylic acid [2-(3,5-difluoro-phenyl)-1-(1H-imidazol-2-ylcarbamoyl)-ethyl]-amide
Reaction equation
[ClH:66].[NH2:47][CH:48]([C:49](=[O:50])[NH:51][c:52]1[nH:53][cH:54][cH:55][n:56]1)[CH2:57][c:58]1[cH:59][c:60]([F:65])[cH:61][c:62]([F:64])[cH:63]1.[P-:23]([F:24])([F:25])([F:26])([F:27])([F:28])[F:29].[cH:1]1[n:2][c:3](-[c:11]2[n:12][c:13]3[c:14]([nH:15]2)[cH:16][cH:17][cH:18][c:19]3[C:20](=[O:21])[OH:22])[cH:4][c:5]2[cH:6][cH:7][cH:8][cH:9][c:10]12.[n:30]1([O:31][C:32]([N:33]([CH3:34])[CH3:35])=[N+:36]([CH3:37])[CH3:38])[c:39]2[cH:40][cH:41][cH:42][cH:43][c:44]2[n:45][n:46]1>>[cH:1]1[n:2][c:3](-[c:11]2[n:12][c:13]3[c:14]([nH:15]2)[cH:16][cH:17][cH:18][c:19]3[C:20](=[O:21])[NH:47][CH:48]([C:49](=[O:50])[NH:51][c:52]2[nH:53][cH:54][cH:55][n:56]2)[CH2:57][c:58]2[cH:59][c:60]([F:65])[cH:61][c:62]([F:64])[cH:63]2)[cH:4][c:5]2[cH:6][cH:7][cH:8][cH:9][c:10]12Participants
6
Reactant 5
Product 1
Sources & evidence
- ORD record
- ord-834fc31b82b14e77bb8d745c6cd7210b
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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