Ethanol → 4-[(4-Hydroxy-3-trifluoromethyl-benzyl)-[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[c:10]([C:30]([F:31])([F:32])[F:33])[cH:11][c:12]([CH2:13][N:14]([c:15]2[cH:16][cH:17][c:18]([C:19]#[N:20])[cH:21][cH:22]2)[n:23]2[cH:24][n:25][n:26][cH:27]2)[cH:28][cH:29]1.[CH2:37]1[O:38][CH2:39][CH2:40][CH2:41]1.[CH3:34][CH2:35][OH:36].[CH3:42][C:43]#[N:44]>>[OH:8][c:9]1[c:10]([C:30]([F:31])([F:32])[F:33])[cH:11][c:12]([CH2:13][N:14]([c:15]2[cH:16][cH:17][c:18]([C:19]#[N:20])[cH:21][cH:22]2)[n:23]2[cH:24][n:25][n:26][cH:27]2)[cH:28][cH:29]1Participants
5
Sources & evidence
- ORD record
- ord-865937696f094872a843bc9d545d3f1f
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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