Water → 3-[4-[4-(6-Chloro-2-pyrazinyl)-1-piperazinyl]butyl]-8,8-dimethyl-3-azabicyclo[3.2.1]octane-2,4-dione
Reaction equation
[CH3:1][C:2]1([CH3:12])[CH:3]2[CH2:4][CH2:5][CH:6]1[C:7](=[O:8])[O:9][C:10]2=[O:11].[NH2:13][CH2:14][CH2:15][CH2:16][CH2:17][N:18]1[CH2:19][CH2:20][N:21]([c:24]2[n:25][c:26]([Cl:30])[cH:27][n:28][cH:29]2)[CH2:22][CH2:23]1.[OH2:39].[c:31]1([CH3:32])[c:33]([CH3:34])[cH:35][cH:36][cH:37][cH:38]1>>[CH3:1][C:2]1([CH3:12])[CH:3]2[CH2:4][CH2:5][CH:6]1[C:7](=[O:9])[N:13]([CH2:14][CH2:15][CH2:16][CH2:17][N:18]1[CH2:19][CH2:20][N:21]([c:24]3[n:25][c:26]([Cl:30])[cH:27][n:28][cH:29]3)[CH2:22][CH2:23]1)[C:10]2=[O:11]Participants
5
Sources & evidence
- ORD record
- ord-2a0640e13ce14665abb7ce66a1925799
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
Loading…