Ethanol → 3-[[4-[2-(2-fluorophenyl)ethenyl]piperidin-1-yl]methyl]-1H-pyrazin-2-one
Reaction equation
[CH3:31][CH2:32][O:33][C:34](=[O:35])[CH3:36].[CH3:37][CH2:38][OH:39].[F:1][c:2]1[c:3]([CH:8]=[CH:9][CH:10]2[CH2:11][CH2:12][N:13]([CH2:16][c:17]3[c:18]([O:23][CH3:24])[n:19][cH:20][cH:21][n:22]3)[CH2:14][CH2:15]2)[cH:4][cH:5][cH:6][cH:7]1.[Na+:25].[Na+:26].[O-:27][C:28](=[O:29])[O-:30].[S:40]([Cl:41])([Cl:42])=[O:43]>>[F:1][c:2]1[c:3]([CH:8]=[CH:9][CH:10]2[CH2:11][CH2:12][N:13]([CH2:16][c:17]3[c:18](=[O:23])[nH:19][cH:20][cH:21][n:22]3)[CH2:14][CH2:15]2)[cH:4][cH:5][cH:6][cH:7]1Participants
7
Sources & evidence
- ORD record
- ord-374e9c76756e45a692fdf61d5a98a7bb
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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