Water → 2-phenyl-4H-1,4-benzothiazin-3-one

HRID 961213

Reaction equation

HRID 961213 reaction equation
[CH3:17][O:18][C:19](=[O:20])[CH:21]([Br:22])[c:23]1[cH:24][cH:25][cH:26][cH:27][cH:28]1.[CH3:42][CH2:43][O:44][C:45]([CH3:46])=[O:47].[NH2:29][c:30]1[cH:31][cH:32][cH:33][cH:34][c:35]1[SH:36].[O:37]=[CH:38][N:39]([CH3:40])[CH3:41].[OH2:48].[c:1]1([CH:7]2[S:8][c:9]3[c:10]([cH:13][cH:14][cH:15][cH:16]3)[NH:11][CH2:12]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([CH:7]2[S:8][c:9]3[c:10]([cH:13][cH:14][cH:15][cH:16]3)[NH:11][C:12]2=[O:18])[cH:2][cH:3][cH:4][cH:5][cH:6]1

Participants

7

Reactant 6

HCID 962WaterHCID 6228DimethylformamideHCID 87132-AminothiophenolHCID 8857Ethyl AcetateHCID 137806Benzeneacetic acid, alpha-bromo-, methyl esterHCID 130715212-Phenyl-3,4-dihydro-2H-1,4-benzothiazine

Product 1

HCID 2347682-phenyl-4H-1,4-benzothiazin-3-one

Sources & evidence

ORD record
ord-b674ecf0696c43758f854ff506a11353
Source dataset
Validation data from https://doi.org/10.1039/C8SC04228D

Linked notes

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