Hydrochloric Acid → 2-[3-fluoro-4-(trifluoromethyl)phenyl]-N-[2-[1-(3-hydroxyazetidin-1-yl)propan-2-yl]-6-methyl-1-oxoisoquinolin-5-yl]acetamide
Reaction equation
[CH2:49]([Cl:50])[Cl:51].[CH3:1][S:2]([O:3][CH2:6][CH:7]([CH3:8])[n:9]1[c:10](=[O:35])[c:11]2[cH:12][cH:13][c:14]([CH3:34])[c:15]([NH:19][C:20]([CH2:21][c:22]3[cH:23][c:24]([F:32])[c:25]([C:28]([F:29])([F:30])[F:31])[cH:26][cH:27]3)=[O:33])[c:16]2[cH:17][cH:18]1)(=[O:4])=[O:5].[CH3:42][CH2:43][N:44]([CH2:45][CH3:46])[CH2:47][CH3:48].[ClH:36].[OH:37][CH:38]1[CH2:39][NH:40][CH2:41]1>>[CH2:6]([CH:7]([CH3:8])[n:9]1[c:10](=[O:35])[c:11]2[cH:12][cH:13][c:14]([CH3:34])[c:15]([NH:19][C:20]([CH2:21][c:22]3[cH:23][c:24]([F:32])[c:25]([C:28]([F:29])([F:30])[F:31])[cH:26][cH:27]3)=[O:33])[c:16]2[cH:17][cH:18]1)[N:40]1[CH2:39][CH:38]([OH:37])[CH2:41]1Participants
6
Reactant 5
Product 1
Sources & evidence
- ORD record
- ord-7a1782fc787e43ab96ea1f4c5243ff24
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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