Isopropanol → 2-chloro-5-(2,2-difluoropropyl)-6a-methyl-6a,7,9,10-tetrahydro-[1,4]oxazino[3,4-h]pteridin-6(5H)-one
Reaction equation
[C:36](=[O:37])([O-:38])[O-:39].[CH3:42][CH2:43][O:44][C:45]([CH3:46])=[O:47].[CH:48]([OH:49])([CH3:50])[CH3:51].[Cl:1][c:2]1[n:3][c:4]2[c:9]([cH:10][n:11]1)[NH:8][C:7](=[O:12])[C:6]1([CH3:17])[N:5]2[CH2:16][CH2:15][O:14][CH2:13]1.[Cs+:40].[Cs+:41].[N+:18]([c:19]1[cH:20][cH:21][c:22]([S:23]([O:24][CH2:31][C:32]([CH3:33])([F:34])[F:35])(=[O:25])=[O:26])[cH:27][cH:28]1)([O-:29])=[O:30]>>[Cl:1][c:2]1[n:3][c:4]2[c:9]([cH:10][n:11]1)[N:8]([CH2:31][C:32]([CH3:33])([F:34])[F:35])[C:7](=[O:12])[C:6]1([CH3:17])[N:5]2[CH2:16][CH2:15][O:14][CH2:13]1Participants
7
Reactant 6
Product 1
Sources & evidence
- ORD record
- ord-ba5fd5fbe06545b29e75a8afe777e8cc
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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