Vitas-M small molecule compound

(3Z)-3-(4-hydroxy-3-methoxybenzylidene)-2,3-dihydro-4H-1,2-benzothiazin-4-one 1,1-dioxide

Catalog ID
STK623429
SMILES COc1cc(ccc1O)/C=C/1\NS(=O)(=O)c2c(C1=O)cccc2

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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 C16H13NO5S MW 331.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13NO5S/c1-22-14-9-10(6-7-13(14)18)8-12-16(19)11-4-2-3-5-15(11)23(20,21)17-12/h2-9,17-18H,1H3/b12-8-
InChIKey
ZOJZUSQFTGNIOP-WQLSENKSSA-N
Synonyms
929812-39-5
(3Z)3((4hydroxy3methoxyphenyl)methylidene)11dioxo1$l^(6)2benzothiazin4one
(3Z)3(4hydroxy3methoxybenzylidene)23dihydro4H12benzothiazin4one11dioxide
(Z)3(4hydroxy3methoxybenzylidene)2Hbenzo(e)(12)thiazin4(3H)one11dioxide
929812395
COC1=C(C=CC(=C1)C=C2C(=O)C3=CC=CC=C3S(=O)(=O)N2)O
COc1cc(ccc1O)C=C1NS(=O)(=O)c2c(C1=O)cccc2
InChI=1SC16H13NO5Sc12214910(6713(14)18)81216(19)11423515(11)23(2021)1712h291718H1H3b128
MFCD09793206
ZINC000009421810
ZINC09421810
ZINC9421810

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Available files

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