Vitas-M small molecule compound
benzyl {[3-cyano-4-(2-methoxyphenyl)-6-phenylpyridin-2-yl]sulfanyl}acetate
Catalog ID
STK860437
SMILES COc1ccccc1c1cc(nc(c1C#N)SCC(=O)OCc1ccccc1)c1ccccc1
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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 C28H22N2O3S MW 466.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H22N2O3S/c1-32-26-15-9-8-14-22(26)23-16-25(21-12-6-3-7-13-21)30-28(24(23)17-29)34-19-27(31)33-18-20-10-4-2-5-11-20/h2-16H,18-19H2,1H3InChIKey
LIWMCTSGLNFLAQ-UHFFFAOYSA-NSynonyms
312757-88-3312757883
benzyl((3cyano4(2methoxyphenyl)6phenylpyridin2yl)sulfanyl)acetate
benzyl2((3cyano4(2methoxyphenyl)6phenylpyridin2yl)thio)acetate
BENZYL2(3CYANO4(2METHOXYPHENYL)6PHENYLPYRIDIN2YL)SULFANYLACETATE
COC1=CC=CC=C1C2=CC(=NC(=C2C#N)SCC(=O)OCC3=CC=CC=C3)C4=CC=CC=C4
InChI=1SC28H22N2O3Sc1322615981422(26)231625(21126371321)3028(24(23)1729)341927(31)331820104251120h216H1819H21H3
MFCD00315786
ZINC000009144839
ZINC09144839
ZINC9144839
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