Ethanol → 1-(4-Cyanophenyl)-4-hydroxycarbonyl-2-methyl-3-[4-(2-pyridyl)phenyl]-2H-pyrazol-5-one
Reaction equation
[C:1](#[N:2])[c:3]1[cH:4][cH:5][c:6](-[n:9]2[n:10]([CH3:32])[c:11](-[c:20]3[cH:21][cH:22][c:23](-[c:26]4[n:27][cH:28][cH:29][cH:30][cH:31]4)[cH:24][cH:25]3)[c:12]([C:15](=[O:16])[O:17][CH2:18][CH3:19])[c:13]2=[O:14])[cH:7][cH:8]1.[C:33](=[O:34])([O-:35])[O-:36].[CH3:39][CH2:40][OH:41].[K+:37].[K+:38].[OH2:42]>>[C:1](#[N:2])[c:3]1[cH:4][cH:5][c:6](-[n:9]2[n:10]([CH3:32])[c:11](-[c:20]3[cH:21][cH:22][c:23](-[c:26]4[n:27][cH:28][cH:29][cH:30][cH:31]4)[cH:24][cH:25]3)[c:12]([C:15](=[O:16])[OH:17])[c:13]2=[O:14])[cH:7][cH:8]1Participants
6
Sources & evidence
- ORD record
- ord-e57c65a7423a4087848eae1a03f64c3a
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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