3-Fluoro-5-methylbenzenemethanamine → 2-[1-[2-(6-tert-butyl-4-ethoxy-3-pyridinyl)-4,5-bis(4-chlorophenyl)-4,5-dimethylimidazole-1-carbonyl]piperidin-4-yl]-N-[(3-fluoro-5-methylphenyl)methyl]acetamide
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][c:7]([O:44][CH2:45][CH3:46])[c:8]([C:11]2=[N:15][C:14]([CH3:16])([c:17]3[cH:18][cH:19][c:20]([Cl:23])[cH:21][cH:22]3)[C:13]([CH3:24])([c:25]3[cH:26][cH:27][c:28]([Cl:31])[cH:29][cH:30]3)[N:12]2[C:32](=[O:33])[N:34]2[CH2:35][CH2:36][CH:37]([CH2:40][C:41](=[O:42])[OH:43])[CH2:38][CH2:39]2)[cH:9][n:10]1.[F:47][c:48]1[cH:49][c:50]([CH2:51][NH2:52])[cH:53][c:54]([CH3:56])[cH:55]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][c:7]([O:44][CH2:45][CH3:46])[c:8]([C:11]2=[N:15][C:14]([CH3:16])([c:17]3[cH:18][cH:19][c:20]([Cl:23])[cH:21][cH:22]3)[C:13]([CH3:24])([c:25]3[cH:26][cH:27][c:28]([Cl:31])[cH:29][cH:30]3)[N:12]2[C:32](=[O:33])[N:34]2[CH2:35][CH2:36][CH:37]([CH2:40][C:41](=[O:42])[NH:52][CH2:51][c:50]3[cH:49][c:48]([F:47])[cH:55][c:54]([CH3:56])[cH:53]3)[CH2:38][CH2:39]2)[cH:9][n:10]1Participants
3
Sources & evidence
- ORD record
- ord-b7278bfca8534780a63f1b67a7f4e79b
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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