Ethanol → 2-(2-ethyl-5,7-dimethyl-3H-imidazo[4,5-b]pyridin-3-yl)methyl-10,11-dihydro-5H-dibenzo[b,f]azepine
Reaction equation
[CH3:32][O-:33].[CH3:35][OH:36].[CH3:37][CH2:38][OH:39].[CH:1](=[O:2])[N:3]1[c:4]2[c:5]([cH:14][c:15]([CH2:18][n:19]3[c:20]([CH2:30][CH3:31])[n:21][c:22]4[c:23]3[n:24][c:25]([CH3:29])[cH:26][c:27]4[CH3:28])[cH:16][cH:17]2)[CH2:6][CH2:7][c:8]2[c:9]1[cH:10][cH:11][cH:12][cH:13]2.[Na+:34]>>[NH:3]1[c:4]2[c:5]([cH:14][c:15]([CH2:18][n:19]3[c:20]([CH2:30][CH3:31])[n:21][c:22]4[c:23]3[n:24][c:25]([CH3:29])[cH:26][c:27]4[CH3:28])[cH:16][cH:17]2)[CH2:6][CH2:7][c:8]2[c:9]1[cH:10][cH:11][cH:12][cH:13]2Participants
6
Sources & evidence
- ORD record
- ord-c623304ab7b74f40b043c994c5e44f6d
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
Loading…