Acetic Acid → 4-(4-fluorophenyl)-3-[4-(methylsulfonyl)phenyl]-1-propargyl-5-(trifluoromethyl)-1H-pyrazole
Reaction equation
[CH3:31][C:32]([OH:33])=[O:34].[F:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[c:9](-[c:20]3[cH:21][cH:22][c:23]([S:26][CH3:27])[cH:24][cH:25]3)[n:10][n:11]([CH2:17][C:18]#[CH:19])[c:12]2[C:13]([F:14])([F:15])[F:16])[cH:6][cH:7]1.[OH2:30].[OH:28][OH:29]>>[F:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[c:9](-[c:20]3[cH:21][cH:22][c:23]([S:26]([CH3:27])(=[O:30])=[O:33])[cH:24][cH:25]3)[n:10][n:11]([CH2:17][C:18]#[CH:19])[c:12]2[C:13]([F:14])([F:15])[F:16])[cH:6][cH:7]1Participants
5
Sources & evidence
- ORD record
- ord-c1e6cef620fd42ecaacfefa0b6251442
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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