tert-Butanol → 5-(5-Bromo-2-fluoro-phenyl)-5-difluoromethyl-[1,4]oxazepan-3-one
Reaction equation
[Br:1][c:2]1[cH:3][cH:4][c:5]([F:20])[c:6]([C:8]([CH2:9][CH2:10][OH:11])([CH:12]([F:13])[F:14])[NH:15][C:16]([CH2:17][Cl:18])=[O:19])[cH:7]1.[C:21]([OH:22])([CH3:23])([CH3:24])[CH3:25].[CH2:26]1[O:27][CH2:28][CH2:29][CH2:30]1>>[Br:1][c:2]1[cH:3][cH:4][c:5]([F:20])[c:6]([C:8]2([CH:12]([F:13])[F:14])[CH2:9][CH2:10][O:11][CH2:17][C:16](=[O:19])[NH:15]2)[cH:7]1Participants
4
Sources & evidence
- ORD record
- ord-d36ee34f44694432a922be3d8d335f35
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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