Ethanol → 4-[N-(4-hydroxyphenylmethyl)-N-(1H-imidazol-1-yl)amino]benzonitrile
Reaction equation
[CH2:31]1[O:32][CH2:33][CH2:34][CH2:35]1.[CH3:36][CH2:37][OH:38].[CH3:39][CH2:40][O:41][C:42](=[O:43])[CH3:44].[K+:24].[K+:25].[O-:26][C:27]([O-:28])=[O:29].[OH2:30].[OH:1][c:2]1[cH:3][cH:4][c:5]([CH2:6][Br:7])[cH:8][cH:9]1.[n:10]1([NH:15][c:16]2[cH:17][cH:18][c:19]([C:20]#[N:21])[cH:22][cH:23]2)[cH:11][n:12][cH:13][cH:14]1>>[OH:1][c:2]1[cH:3][cH:4][c:5]([CH2:6][N:15]([n:10]2[cH:11][n:12][cH:13][cH:14]2)[c:16]2[cH:17][cH:18][c:19]([C:20]#[N:21])[cH:22][cH:23]2)[cH:8][cH:9]1Participants
9
Sources & evidence
- ORD record
- ord-df615589f7614a37b10c06c835e75143
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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