Vitas-M small molecule compound
(2E)-3-{4-[2-(4-chlorophenyl)-2-oxoethoxy]-3-methoxyphenyl}-2-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
Catalog ID
STK604200
SMILES COc1cc(ccc1OCC(=O)c1ccc(cc1)Cl)/C=C(/c1scc(n1)c1ccc(cc1)F)\C#N
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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 C27H18ClFN2O3S MW 504.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H18ClFN2O3S/c1-33-26-13-17(2-11-25(26)34-15-24(32)19-3-7-21(28)8-4-19)12-20(14-30)27-31-23(16-35-27)18-5-9-22(29)10-6-18/h2-13,16H,15H2,1H3/b20-12+InChIKey
LVKGAAZWSVXHIK-UDWIEESQSA-NSynonyms
477296-90-5(2E)3(4(2(4chlorophenyl)2oxoethoxy)3methoxyphenyl)2(4(4fluorophenyl)13thiazol2yl)prop2enenitrile
(E)3(4(2(4CHLOROPHENYL)2OXOETHOXY)3METHOXYPHENYL)2(4(4FLUOROPHENYL)13THIAZOL2YL)PROP2ENENITRILE
(E)3(4(2(4chlorophenyl)2oxoethoxy)3methoxyphenyl)2(4(4fluorophenyl)thiazol2yl)acrylonitrile
477296905
COC1=C(C=CC(=C1)C=C(C#N)C2=NC(=CS2)C3=CC=C(C=C3)F)OCC(=O)C4=CC=C(C=C4)Cl
COc1cc(ccc1OCC(=O)c1ccc(cc1)Cl)C=C(c1scc(n1)c1ccc(cc1)F)C#N
InChI=1SC27H18ClFN2O3Sc133261317(21125(26)341524(32)193721(28)8419)1220(1430)273123(163527)185922(29)10618h21316H15H21H3b2012+
MFCD03669055
ZINC000013648108
ZINC13648108
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