Bicarbonate Ion → 3(2H)-Isothiazolone, 2-butyl-5-phenyl-4-[(1,2,3,4-tetrahydro-6-isoquinolinyl)amino]-, 1,1-dioxide
Reaction equation
[CH2:1]([CH2:2][CH2:3][CH3:4])[N:5]1[S:6](=[O:35])(=[O:36])[C:7]([c:29]2[cH:30][cH:31][cH:32][cH:33][cH:34]2)=[C:8]([NH:11][c:12]2[cH:13][c:14]3[c:19]([cH:20][cH:21]2)[CH2:18][N:17]([C:22]([O:23][C:24]([CH3:25])([CH3:26])[CH3:27])=[O:28])[CH2:16][CH2:15]3)[C:9]1=[O:10].[Cl:42][CH2:43][Cl:44].[F:45][C:46]([F:47])([F:48])[C:49]([OH:50])=[O:51].[Na+:41].[O-:37][C:38]([OH:39])=[O:40]>>[CH2:1]([CH2:2][CH2:3][CH3:4])[N:5]1[S:6](=[O:35])(=[O:36])[C:7]([c:29]2[cH:30][cH:31][cH:32][cH:33][cH:34]2)=[C:8]([NH:11][c:12]2[cH:13][c:14]3[c:19]([cH:20][cH:21]2)[CH2:18][NH:17][CH2:16][CH2:15]3)[C:9]1=[O:10]Participants
6
Sources & evidence
- ORD record
- ord-2840f456d7614cd48d48febe78da341b
- Source dataset
- Test data from https://doi.org/10.1039/C8SC04228D
Reaction notes
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