Sodium ion → 2-Chloro-9-cyclohexyl-7-fluoro-5,7-dimethyl-8,9-dihydro-5H-pyrimido[4,5-b][1,4]diazepin-6(7H)-one
Reaction equation
[CH3:24][I:25].[Cl:1][c:2]1[n:3][cH:4][c:5]2[c:6]([n:21]1)[N:7]([CH:15]1[CH2:16][CH2:17][CH2:18][CH2:19][CH2:20]1)[CH2:8][C:9]([CH3:13])([F:14])[C:10](=[O:12])[NH:11]2.[H-:22].[Na+:23]>>[Cl:1][c:2]1[n:3][cH:4][c:5]2[c:6]([n:21]1)[N:7]([CH:15]1[CH2:16][CH2:17][CH2:18][CH2:19][CH2:20]1)[CH2:8][C:9]([CH3:13])([F:14])[C:10](=[O:12])[N:11]2[CH3:24]Participants
5
Sources & evidence
- ORD record
- ord-7a01f127111c4100ad121abd86bba55a
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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