4-Methylpyrazole → 3-Fluoro-4-{4-[5-methanesulfonyl-2-(4-methyl-pyrazol-1-yl)-benzoyl]-piperazin-1-yl}-benzonitrile
Reaction equation
[CH3:29][c:30]1[cH:31][n:32][nH:33][cH:34]1.[F:1][c:2]1[cH:3][c:4]([C:5]#[N:6])[cH:7][cH:8][c:9]1[N:10]1[CH2:11][CH2:12][N:13]([C:16]([c:17]2[c:18]([I:27])[cH:19][cH:20][c:21]([S:23](=[O:24])(=[O:25])[CH3:26])[cH:22]2)=[O:28])[CH2:14][CH2:15]1>>[F:1][c:2]1[cH:3][c:4]([C:5]#[N:6])[cH:7][cH:8][c:9]1[N:10]1[CH2:11][CH2:12][N:13]([C:16]([c:17]2[c:18](-[n:32]3[cH:31][c:30]([CH3:29])[cH:34][n:33]3)[cH:19][cH:20][c:21]([S:23](=[O:24])(=[O:25])[CH3:26])[cH:22]2)=[O:28])[CH2:14][CH2:15]1Participants
3
Sources & evidence
- ORD record
- ord-c6742a94820c472b878ce81038e03383
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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