Vitas-M small molecule compound

(3Z)-3-(thiophen-2-ylmethylidene)-2,3-dihydro-4H-1,2-benzothiazin-4-one 1,1-dioxide

Catalog ID
STL011321
SMILES O=C1/C(=C/c2cccs2)/NS(=O)(=O)c2c1cccc2

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C13H9NO3S2 MW 291.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H9NO3S2/c15-13-10-5-1-2-6-12(10)19(16,17)14-11(13)8-9-4-3-7-18-9/h1-8,14H/b11-8-
InChIKey
KESOFPZGISYIOQ-FLIBITNWSA-N
Synonyms
929832-18-8
(3Z)11dioxo3(thiophen2ylmethylidene)1$l^(6)2benzothiazin4one
(3Z)3(thiophen2ylmethylidene)23dihydro4H12benzothiazin4one11dioxide
(Z)3(thiophen2ylmethylene)2Hbenzo(e)(12)thiazin4(3H)one11dioxide
929832188
C1=CC=C2C(=C1)C(=O)C(=CC3=CC=CS3)NS2(=O)=O
InChI=1SC13H9NO3S2c151310512612(10)19(1617)1411(13)89437189h1814Hb118
MFCD09847132
O=C1C(=Cc2cccs2)NS(=O)(=O)c2c1cccc2
ZINC000009421830
ZINC09421830
ZINC9421830

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.