Tert-Butylamine → 5-{[(1,1-Dimethylethyl)amino]sulfonyl}-2,4-difluorobenzoic acid
Reaction equation
[C:16]([CH3:17])([CH3:18])([CH3:19])[NH2:20].[CH:21]([N:22]([CH2:23][CH3:24])[CH:25]([CH3:26])[CH3:27])([CH3:28])[CH3:29].[Cl:1][S:2](=[O:3])(=[O:4])[c:5]1[c:6]([F:15])[cH:7][c:8]([F:14])[c:9]([C:10](=[O:11])[OH:12])[cH:13]1.[Cl:30][c:31]1[c:32]([S:33]([NH:34][CH3:35])(=[O:36])=[O:37])[cH:38][cH:39][c:40]([Cl:41])[c:42]1[C:43]([OH:44])=[O:45]>>[S:2](=[O:3])(=[O:4])([c:5]1[c:6]([F:15])[cH:7][c:8]([F:14])[c:9]([C:10](=[O:11])[OH:12])[cH:13]1)[NH:20][C:16]([CH3:17])([CH3:18])[CH3:19]Participants
5
Sources & evidence
- ORD record
- ord-2d7257eccb0345babb4681be5dfda85f
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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