1-Butanol → 4-[6-Chloro-2-[1-(4-fluorophenyl)ethylamino]pyrimidin-4-yl]piperazin-2-one
Reaction equation
[CH2:35]([OH:36])[CH2:37][CH2:38][CH3:39].[CH3:40][CH2:41][O:42][C:43](=[O:44])[CH3:45].[CH:26]([N:27]([CH2:28][CH3:29])[CH:30]([CH3:31])[CH3:32])([CH3:33])[CH3:34].[Cl:1][c:2]1[n:3][c:4]([NH:9][CH:10]([CH3:11])[c:12]2[cH:13][cH:14][c:15]([F:18])[cH:16][cH:17]2)[n:5][c:6]([Cl:8])[cH:7]1.[NH:19]1[C:20](=[O:25])[CH2:21][NH:22][CH2:23][CH2:24]1>>[c:2]1([N:22]2[CH2:21][C:20](=[O:25])[NH:19][CH2:24][CH2:23]2)[n:3][c:4]([NH:9][CH:10]([CH3:11])[c:12]2[cH:13][cH:14][c:15]([F:18])[cH:16][cH:17]2)[n:5][c:6]([Cl:8])[cH:7]1Participants
6
Sources & evidence
- ORD record
- ord-62744f34bdde413bab3dff4be9ac47f1
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
Loading…