Sodium ion → 4-Chloro-3-(5-isopropyl-2,6-dimethoxy-pyrimidine-4-carbonyl)-5-methyl-benzonitrile
Reaction equation
[Cl:15][c:16]1[c:17]([CH2:25][C:26]#[N:27])[cH:18][c:19]([C:20]#[N:21])[cH:22][c:23]1[CH3:24].[Cl:1][c:2]1[n:3][c:4]([O:13][CH3:14])[n:5][c:6]([O:11][CH3:12])[c:7]1[CH:8]([CH3:9])[CH3:10].[H-:29].[Na+:28].[O:30]=[CH:31][N:32]([CH3:33])[CH3:34]>>[c:2]1([C:25]([c:17]2[c:16]([Cl:15])[c:23]([CH3:24])[cH:22][c:19]([C:20]#[N:21])[cH:18]2)=[O:30])[n:3][c:4]([O:13][CH3:14])[n:5][c:6]([O:11][CH3:12])[c:7]1[CH:8]([CH3:9])[CH3:10]Participants
6
Sources & evidence
- ORD record
- ord-66305bef140c4716b9734e235aa01a44
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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