Vitas-M small molecule compound

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

Catalog ID
STK521867
SMILES C=CCSC1=N/C(=C\c2ccc(c(c2)OC)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 C21H19NO3S2 MW 397.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19NO3S2/c1-3-11-26-21-22-17(20(23)27-21)12-16-9-10-18(19(13-16)24-2)25-14-15-7-5-4-6-8-15/h3-10,12-13H,1,11,14H2,2H3/b17-12-
InChIKey
IPRXEWBLPPRLNC-ATVHPVEESA-N
Synonyms

(4Z)4((3METHOXY4PHENYLMETHOXYPHENYL)METHYLIDENE)2PROP2ENYLSULFANYL13THIAZOL5ONE
(4Z)4(4(benzyloxy)3methoxybenzylidene)2(prop2en1ylsulfanyl)13thiazol5(4H)one
C=CCSC1=NC(=Cc2ccc(c(c2)OC)OCc2ccccc2)C(=O)S1
COC1=C(C=CC(=C1)C=C2C(=O)SC(=N2)SCC=C)OCC3=CC=CC=C3
InChI=1SC21H19NO3S2c131126212217(20(23)2721)121691018(19(1316)242)2514157546815h3101213H11114H22H3b1712
MFCD03709331
ZINC000003002044
ZINC03002044
ZINC3002044

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Available files

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