2-Methylpentane → 4-Bromo-2-[2-(dimethylamino)ethenyl]benzonitrile
Reaction equation
[Br:1][c:2]1[cH:3][c:4]([CH3:10])[c:5]([C:6]#[N:7])[cH:8][cH:9]1.[C:17]([O:18][CH:22]([N:19]([CH3:20])[CH3:21])[N:23]([CH3:24])[CH3:25])([CH3:26])([CH3:27])[CH3:28].[CH3:11][CH2:12][CH2:13][CH:14]([CH3:15])[CH3:16]>>[Br:1][c:2]1[cH:3][c:4]([CH:10]=[CH:22][N:23]([CH3:24])[CH3:25])[c:5]([C:6]#[N:7])[cH:8][cH:9]1Participants
4
Sources & evidence
- ORD record
- ord-81a0ed0e2d394a32b190576cd47bba10
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
Loading…