Water → [1-Oxo-1-[4-(trifluoromethyl)anilino]pentan-3-yl] 4-methylbenzenesulfonate
Reaction equation
[CH3:25][c:26]1[cH:27][cH:28][c:29]([S:32](=[O:33])(=[O:34])[Cl:35])[cH:30][cH:31]1.[F:1][C:2]([c:3]1[cH:4][cH:5][c:6]([NH:9][C:10]([CH2:11][CH:12]([CH2:13][CH3:14])[OH:15])=[O:16])[cH:7][cH:8]1)([F:17])[F:18].[OH2:36].[cH:19]1[cH:20][cH:21][n:22][cH:23][cH:24]1>>[F:1][C:2]([c:3]1[cH:4][cH:5][c:6]([NH:9][C:10]([CH2:11][CH:12]([CH2:13][CH3:14])[O:15][S:32]([c:29]2[cH:28][cH:27][c:26]([CH3:25])[cH:31][cH:30]2)(=[O:33])=[O:34])=[O:16])[cH:7][cH:8]1)([F:17])[F:18]Participants
5
Sources & evidence
- ORD record
- ord-8d577e4a65074ce8b058593ca9df0d4d
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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