Vitas-M small molecule compound

(3Z)-3-(3-hydroxybenzylidene)-2-(pyridin-4-ylmethyl)-2,3-dihydro-4H-1,2-benzothiazin-4-one 1,1-dioxide

Catalog ID
STL011257
SMILES Oc1cccc(c1)/C=C\1/C(=O)c2ccccc2S(=O)(=O)N1Cc1ccncc1

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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 C21H16N2O4S MW 392.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16N2O4S/c24-17-5-3-4-16(12-17)13-19-21(25)18-6-1-2-7-20(18)28(26,27)23(19)14-15-8-10-22-11-9-15/h1-13,24H,14H2/b19-13-
InChIKey
LDOGFQJDGHHSBF-UYRXBGFRSA-N
Synonyms
929848-52-2
(3Z)3((3hydroxyphenyl)methylidene)11dioxo2(pyridin4ylmethyl)1$l^(6)2benzothiazin4one
(3Z)3(3hydroxybenzylidene)2(pyridin4ylmethyl)23dihydro4H12benzothiazin4one11dioxide
(Z)3(3hydroxybenzylidene)2(pyridin4ylmethyl)2Hbenzo(e)(12)thiazin4(3H)one11dioxide
929848522
C1=CC=C2C(=C1)C(=O)C(=CC3=CC(=CC=C3)O)N(S2(=O)=O)CC4=CC=NC=C4
InChI=1SC21H16N2O4Sc241753416(1217)131921(25)18612720(18)28(2627)23(19)14158102211915h11324H14H2b1913
MFCD09845928
Oc1cccc(c1)C=C1C(=O)c2ccccc2S(=O)(=O)N1Cc1ccncc1
ZINC000009422929
ZINC09422929
ZINC9422929

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Available files

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