Ethanol → 4-{[2-(4-Hydroxyphenyl)ethyl]-[1,2,4]triazol-4-yl-amino}benzonitrile
Reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[cH:10][cH:11][c:12]([CH2:15][CH2:16][N:17]([c:18]2[cH:19][cH:20][c:21]([C:22]#[N:23])[cH:24][cH:25]2)[n:26]2[cH:27][n:28][n:29][cH:30]2)[cH:13][cH:14]1.[CH2:42]1[O:43][CH2:44][CH2:45][CH2:46]1.[CH3:31][CH2:32][OH:33].[CH3:36][CH2:37][O:38][C:39](=[O:40])[CH3:41].[H:34][H:35]>>[OH:8][c:9]1[cH:10][cH:11][c:12]([CH2:15][CH2:16][N:17]([c:18]2[cH:19][cH:20][c:21]([C:22]#[N:23])[cH:24][cH:25]2)[n:26]2[cH:27][n:28][n:29][cH:30]2)[cH:13][cH:14]1Participants
6
Sources & evidence
- ORD record
- ord-8086b2c539a94481a741097749772ef0
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
Loading…