Vitas-M small molecule compound

(2E)-3-[3-(benzyloxy)-4-methoxyphenyl]-2-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]prop-2-enenitrile

Catalog ID
STL115822
SMILES N#C/C(=C\c1ccc(c(c1)OCc1ccccc1)OC)/c1scc(n1)c1ccc(cc1)F

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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 C26H19FN2O2S MW 442.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H19FN2O2S/c1-30-24-12-7-19(14-25(24)31-16-18-5-3-2-4-6-18)13-21(15-28)26-29-23(17-32-26)20-8-10-22(27)11-9-20/h2-14,17H,16H2,1H3/b21-13+
InChIKey
IEYOMVKQMPSTGD-FYJGNVAPSA-N
Synonyms

(2E)3(3(benzyloxy)4methoxyphenyl)2(4(4fluorophenyl)13thiazol2yl)prop2enenitrile
(E)2(4(4FLUOROPHENYL)13THIAZOL2YL)3(4METHOXY3PHENYLMETHOXYPHENYL)PROP2ENENITRILE
COC1=C(C=C(C=C1)C=C(C#N)C2=NC(=CS2)C3=CC=C(C=C3)F)OCC4=CC=CC=C4
InChI=1SC26H19FN2O2Sc1302412719(1425(24)3116185324618)1321(1528)262923(173226)2081022(27)11920h21417H16H21H3b2113+
MFCD01464628
N#CC(=Cc1ccc(c(c1)OCc1ccccc1)OC)c1scc(n1)c1ccc(cc1)F
ZINC000008387342
ZINC08387342
ZINC8387342

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Available files

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