Dimethylformamide → 1,3-dimethyl-6-{4-[3-(2-cyano-4-nitroanilino)propyl]piperazin-1-yl}-2,4(1H,3H)-pyrimidinedione
Reaction equation
[CH3:1][n:2]1[c:3](=[O:20])[n:4]([CH3:19])[c:5](=[O:18])[cH:6][c:7]1[N:8]1[CH2:9][CH2:10][N:11]([CH2:14][CH2:15][CH2:16][NH2:17])[CH2:12][CH2:13]1.[CH3:33][N:34]([CH3:35])[CH:36]=[O:37].[Cl:21][c:22]1[c:23]([C:24]#[N:25])[cH:26][c:27]([N+:30](=[O:31])[O-:32])[cH:28][cH:29]1>>[CH3:1][n:2]1[c:3](=[O:20])[n:4]([CH3:19])[c:5](=[O:18])[cH:6][c:7]1[N:8]1[CH2:9][CH2:10][N:11]([CH2:14][CH2:15][CH2:16][NH:17][c:22]2[c:23]([C:24]#[N:25])[cH:26][c:27]([N+:30](=[O:31])[O-:32])[cH:28][cH:29]2)[CH2:12][CH2:13]1Participants
4
Sources & evidence
- ORD record
- ord-71fcc079954f4530b677a47a0c2627ab
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)