Water → 4-(2,5-Dimethylpiperazin-1-yl)-2-(trifluoromethyl)benzonitrile
Reaction equation
[CH3:14][CH:15]1[NH:16][CH2:17][CH:18]([CH3:21])[NH:19][CH2:20]1.[F:1][c:2]1[cH:3][c:4]([C:10]([F:11])([F:12])[F:13])[c:5]([C:6]#[N:7])[cH:8][cH:9]1.[O:23]=[CH:24][N:25]([CH3:26])[CH3:27].[OH2:22]>>[c:2]1([N:16]2[CH:15]([CH3:14])[CH2:20][NH:19][CH:18]([CH3:21])[CH2:17]2)[cH:3][c:4]([C:10]([F:11])([F:12])[F:13])[c:5]([C:6]#[N:7])[cH:8][cH:9]1Participants
5
Sources & evidence
- ORD record
- ord-67129df993cf4ed694377ec3c42801b1
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
Loading…