Benzyl Alcohol → 4-Benzyloxy-N-(4-fluorobenzyl)-5-methoxy-6-methylnicotinamide
Reaction equation
[CH2:30]([P:31]([CH2:32][CH2:33][CH2:34][CH3:35])[CH2:36][CH2:37][CH2:38][CH3:39])[CH2:40][CH2:41][CH3:42].[F:1][c:2]1[cH:3][cH:4][c:5]([CH2:6][NH:7][C:8]([c:9]2[cH:10][n:11][c:12]([CH3:18])[c:13]([O:16][CH3:17])[c:14]2[OH:15])=[O:19])[cH:20][cH:21]1.[N:50]([C:51]([O:52][CH:53]([CH3:54])[CH3:55])=[O:56])=[N:57][C:58]([O:59][CH:60]([CH3:61])[CH3:62])=[O:63].[O:64]1[CH2:65][CH2:66][CH2:67][CH2:68]1.[OH:22][CH2:23][c:24]1[cH:25][cH:26][cH:27][cH:28][cH:29]1.[c:43]1([CH3:44])[cH:45][cH:46][cH:47][cH:48][cH:49]1>>[F:1][c:2]1[cH:3][cH:4][c:5]([CH2:6][NH:7][C:8]([c:9]2[cH:10][n:11][c:12]([CH3:18])[c:13]([O:16][CH3:17])[c:14]2[O:15][CH2:23][c:24]2[cH:25][cH:26][cH:27][cH:28][cH:29]2)=[O:19])[cH:20][cH:21]1Participants
7
Sources & evidence
- ORD record
- ord-31395afd41374c808d82977e05195cfc
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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