Dichloromethane → n-{2-[4-(2-Tert-butyl-1,1,3-trioxo-2,3-dihydro-1h-1lambda6-isothiazol-5-yl)-phenyl]-1-cyano-ethyl}-3-trifluoromethyl-benzenesulfonamide
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[N:5]1[S:6](=[O:36])(=[O:37])[C:7]([c:11]2[cH:12][cH:13][c:14]([CH2:17][CH:18]([C:19](=[O:20])[NH2:21])[NH:22][S:23](=[O:24])(=[O:25])[c:26]3[cH:27][c:28]([C:32]([F:33])([F:34])[F:35])[cH:29][cH:30][cH:31]3)[cH:15][cH:16]2)=[CH:8][C:9]1=[O:10].[CH2:52]([Cl:53])[Cl:54].[CH3:38][CH2:39][N:40]([CH2:41][CH3:42])[CH2:43][CH3:44].[CH3:55][CH2:56][O:57][C:58](=[O:59])[CH3:60].[Cl:45][C:46]([Cl:47])([Cl:48])[C:49]([Cl:50])=[O:51]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[N:5]1[S:6](=[O:36])(=[O:37])[C:7]([c:11]2[cH:12][cH:13][c:14]([CH2:17][CH:18]([C:19]#[N:21])[NH:22][S:23](=[O:24])(=[O:25])[c:26]3[cH:27][c:28]([C:32]([F:33])([F:34])[F:35])[cH:29][cH:30][cH:31]3)[cH:15][cH:16]2)=[CH:8][C:9]1=[O:10]Participants
6
Reactant 5
Product 1
Sources & evidence
- ORD record
- ord-9523c72d061042b38eb4763f51ee3aba
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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