Sodium ion → 4-(Butane-1-sulfonyl)-1-methyl-3,5-diphenyl-1H-pyrazole
Reaction equation
[CH2:12]([CH2:13][CH2:14][CH3:15])[S:16][c:17]1[c:18](-[c:29]2[cH:30][cH:31][cH:32][cH:33][cH:34]2)[n:19][n:20]([CH3:28])[c:21]1-[c:22]1[cH:23][cH:24][cH:25][cH:26][cH:27]1.[CH:37]([Cl:38])([Cl:39])[Cl:40].[Cl:1][c:2]1[cH:3][cH:4][cH:5][c:6]([C:7]([O:8][OH:10])=[O:9])[cH:11]1.[Na+:36].[OH-:35]>>[O:9]=[S:16]([CH2:12][CH2:13][CH2:14][CH3:15])([c:17]1[c:18](-[c:29]2[cH:30][cH:31][cH:32][cH:33][cH:34]2)[n:19][n:20]([CH3:28])[c:21]1-[c:22]1[cH:23][cH:24][cH:25][cH:26][cH:27]1)=[O:35]Participants
6
Sources & evidence
- ORD record
- ord-47ed4c7d70b1403fa8141f0841a3d6c7
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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