Acetonitrile → 2-tert-Butyl-5-phenyl-4-[(4-phenylbutyl)amino]isothiazol-3(2H)-one 1,1-dioxide
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[N:5]1[S:6](=[O:18])(=[O:19])[C:7]([c:12]2[cH:13][cH:14][cH:15][cH:16][cH:17]2)=[C:8]([Cl:11])[C:9]1=[O:10].[CH3:31][C:32]#[N:33].[c:20]1([CH2:26][CH2:27][CH2:28][CH2:29][NH2:30])[cH:21][cH:22][cH:23][cH:24][cH:25]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[N:5]1[S:6](=[O:18])(=[O:19])[C:7]([c:12]2[cH:13][cH:14][cH:15][cH:16][cH:17]2)=[C:8]([NH:30][CH2:29][CH2:28][CH2:27][CH2:26][c:20]2[cH:21][cH:22][cH:23][cH:24][cH:25]2)[C:9]1=[O:10]Participants
4
Sources & evidence
- ORD record
- ord-71ab58398d9e404f87892afa4fbc518c
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
Loading…