Vitas-M small molecule compound

(4Z)-4-[4-(benzyloxy)-3-chloro-5-ethoxybenzylidene]-2-(prop-2-en-1-ylsulfanyl)-1,3-thiazol-5(4H)-one

Catalog ID
STK521789
SMILES C=CCSC1=N/C(=C\c2cc(Cl)c(c(c2)OCC)OCc2ccccc2)/C(=O)S1

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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 C22H20ClNO3S2 MW 445.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20ClNO3S2/c1-3-10-28-22-24-18(21(25)29-22)12-16-11-17(23)20(19(13-16)26-4-2)27-14-15-8-6-5-7-9-15/h3,5-9,11-13H,1,4,10,14H2,2H3/b18-12-
InChIKey
WGLPHRSAFXBFEY-PDGQHHTCSA-N
Synonyms

(4Z)4((3CHLORO5ETHOXY4PHENYLMETHOXYPHENYL)METHYLIDENE)2PROP2ENYLSULFANYL13THIAZOL5ONE
(4Z)4(4(benzyloxy)3chloro5ethoxybenzylidene)2(prop2en1ylsulfanyl)13thiazol5(4H)one
C=CCSC1=NC(=Cc2cc(Cl)c(c(c2)OCC)OCc2ccccc2)C(=O)S1
CCOC1=C(C(=CC(=C1)C=C2C(=O)SC(=N2)SCC=C)Cl)OCC3=CC=CC=C3
InChI=1SC22H20ClNO3S2c131028222418(21(25)2922)12161117(23)20(19(1316)2642)2714158657915h3591113H141014H22H3b1812
MFCD03709497
ZINC000003002236
ZINC03002236
ZINC3002236

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Available files

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