Acetic Acid → 4'-Amino-3',5'-dimethyl-2-(methylsulfonyl)-acetophenone
Reaction equation
[CH3:12][O:13][C:14]([c:15]1[cH:16][c:17]([CH3:23])[c:18]([NH2:22])[c:19]([CH3:21])[cH:20]1)=[O:24].[CH3:1][S:2](=[O:3])(=[O:4])[CH3:5].[CH3:25][C:26](=[O:27])[OH:28].[CH3:8][S:9]([CH3:10])=[O:11].[H-:6].[Na+:7].[OH2:29]>>[CH2:1]([S:2](=[O:3])(=[O:4])[CH3:5])[C:14](=[O:13])[c:15]1[cH:16][c:17]([CH3:23])[c:18]([NH2:22])[c:19]([CH3:21])[cH:20]1Participants
8
Sources & evidence
- ORD record
- ord-d4d94c1af8d947558c1cce7a6cf9feb6
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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