Acetone → 3-(2-Fluorophenyl)-4-methyl-5-(methylsulfanyl)-4H-1,2,4-triazole
Reaction equation
[CH3:21][I:22].[CH3:23][C:24](=[O:25])[CH3:26].[F:1][c:2]1[c:3](-[c:8]2[n:9]([CH3:14])[c:10](=[S:13])[nH:11][n:12]2)[cH:4][cH:5][cH:6][cH:7]1.[K+:15].[K+:16].[O-:17][C:18]([O-:19])=[O:20]>>[F:1][c:2]1[c:3](-[c:8]2[n:9]([CH3:14])[c:10]([S:13][CH3:18])[n:11][n:12]2)[cH:4][cH:5][cH:6][cH:7]1Participants
6
Sources & evidence
- ORD record
- ord-abdf4895185a4b8aa21c666e04755a19
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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