Acetate → 4-[3-Chloro-4-[(3,3,3-trifluoro-2-hydroxy-2-methylpropanoyl)amino]phenyl]sulfinylbenzoic acid
Reaction equation
[CH3:29][C:30]([O-:31])=[O:32].[CH3:33][OH:34].[Cl:1][c:2]1[c:3]([NH:18][C:19]([C:20]([C:21]([F:22])([F:23])[F:24])([CH3:25])[OH:26])=[O:27])[cH:4][cH:5][c:6]([S:8][c:9]2[cH:10][cH:11][c:12]([C:15](=[O:16])[OH:17])[cH:13][cH:14]2)[cH:7]1.[Na+:28]>>[Cl:1][c:2]1[c:3]([NH:18][C:19]([C:20]([C:21]([F:22])([F:23])[F:24])([CH3:25])[OH:26])=[O:27])[cH:4][cH:5][c:6]([S:8]([c:9]2[cH:10][cH:11][c:12]([C:15](=[O:16])[OH:17])[cH:13][cH:14]2)=[O:31])[cH:7]1Participants
5
Sources & evidence
- ORD record
- ord-ba349bdf75bc4357b87c58f12efae8d8
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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