Sodium ion → 2-Chloro-9-cyclopentyl-5,7,7-trimethyl-5,7,8,9-tetrahydro-pyrimido[4,5-b][1,4]diazepin-6-one
Reaction equation
[CH3:21][I:22].[Cl:1][c:2]1[n:3][cH:4][c:5]2[c:6]([n:20]1)[N:7]([CH:15]1[CH2:16][CH2:17][CH2:18][CH2:19]1)[CH2:8][C:9]([CH3:13])([CH3:14])[C:10](=[O:12])[NH:11]2.[H-:24].[Na+:23].[O:25]=[CH:26][N:27]([CH3:28])[CH3:29]>>[Cl:1][c:2]1[n:3][cH:4][c:5]2[c:6]([n:20]1)[N:7]([CH:15]1[CH2:16][CH2:17][CH2:18][CH2:19]1)[CH2:8][C:9]([CH3:13])([CH3:14])[C:10](=[O:12])[N:11]2[CH3:21]Participants
6
Reactant 5
Product 1
Sources & evidence
- ORD record
- ord-84f968b3c911470fa854288401fc8310
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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