Acetic Acid → N-(5-amino-2-methylphenyl)-N-(3-chloro-4-fluorophenyl)pyrimidine-4,6-diamine
Reaction equation
[C:27]([OH:28])(=[O:29])[CH3:30].[CH3:31][OH:32].[Cl:1][c:2]1[cH:3][c:4]([N:9]([c:10]2[n:11][cH:12][n:13][c:14]([NH2:16])[cH:15]2)[c:17]2[c:18]([CH3:26])[cH:19][cH:20][c:21]([N+:23]([O-:24])=[O:25])[cH:22]2)[cH:5][cH:6][c:7]1[F:8].[Fe:33]>>[Cl:1][c:2]1[cH:3][c:4]([N:9]([c:10]2[n:11][cH:12][n:13][c:14]([NH2:16])[cH:15]2)[c:17]2[c:18]([CH3:26])[cH:19][cH:20][c:21]([NH2:23])[cH:22]2)[cH:5][cH:6][c:7]1[F:8]Participants
5
Sources & evidence
- ORD record
- ord-2ec0b0427c2140dc9231a0e85642647d
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
Loading…