Water → 2-(3,5-Difluoro-phenoxy)-N-[4-(1-hydroxy-1-methyl-ethyl)-benzyl]-nicotinamide
Reaction equation
[CH3:43][N:44]([CH3:45])[CH:46]=[O:47].[F:1][c:2]1[cH:3][c:4]([O:5][c:6]2[c:7]([C:8](=[O:9])[OH:10])[cH:11][cH:12][cH:13][n:14]2)[cH:15][c:16]([F:18])[cH:17]1.[NH2:19][CH2:20][c:21]1[cH:22][cH:23][c:24]([C:27]([CH3:28])([CH3:29])[OH:30])[cH:25][cH:26]1.[OH2:31].[OH2:42].[OH:32][n:33]1[c:34]2[cH:35][cH:36][cH:37][cH:38][c:39]2[n:40][n:41]1>>[F:1][c:2]1[cH:3][c:4]([O:5][c:6]2[c:7]([C:8](=[O:10])[NH:19][CH2:20][c:21]3[cH:22][cH:23][c:24]([C:27]([CH3:28])([CH3:29])[OH:30])[cH:25][cH:26]3)[cH:11][cH:12][cH:13][n:14]2)[cH:15][c:16]([F:18])[cH:17]1Participants
6
Sources & evidence
- ORD record
- ord-70705118dc354e778334525534efc5d8
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
Loading…