Methanol → 3-[7-[3-(dimethylamino)propyl]-1-oxoisoquinolin-2(1H)-yl]-N-isoxazol-3-yl-4-methylbenzamide
Reaction equation
[CH2:45]([Cl:46])[Cl:47].[CH3:1][N:2]([CH2:3][CH2:4][CH2:5][c:6]1[cH:7][cH:8][c:9]2[cH:10][cH:11][n:12](-[c:17]3[cH:18][c:19]([C:20](=[O:21])[OH:22])[cH:23][cH:24][c:25]3[CH3:26])[c:13](=[O:16])[c:14]2[cH:15]1)[CH3:27].[CH3:48][OH:49].[Cl:28][C:29]([C:30]([Cl:31])=[O:32])=[O:33].[NH2:39][c:40]1[n:41][o:42][cH:43][cH:44]1.[O:34]=[CH:35][N:36]([CH3:37])[CH3:38].[OH2:50]>>[CH3:1][N:2]([CH2:3][CH2:4][CH2:5][c:6]1[cH:7][cH:8][c:9]2[cH:10][cH:11][n:12](-[c:17]3[cH:18][c:19]([C:20](=[O:22])[NH:39][c:40]4[n:41][o:42][cH:43][cH:44]4)[cH:23][cH:24][c:25]3[CH3:26])[c:13](=[O:16])[c:14]2[cH:15]1)[CH3:27]Participants
8
Reactant 7
Product 1
Sources & evidence
- ORD record
- ord-9a02c52cccc944e4a8833259482b3c8f
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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