Vitas-M small molecule compound
ethyl ({4-[4-(benzyloxy)phenyl]-3-cyano-6-oxo-1,4,5,6-tetrahydropyridin-2-yl}sulfanyl)acetate
Catalog ID
STK763807
SMILES CCOC(=O)CSC1=C(C#N)C(CC(=O)N1)c1ccc(cc1)OCc1ccccc1
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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 C23H22N2O4S MW 422.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22N2O4S/c1-2-28-22(27)15-30-23-20(13-24)19(12-21(26)25-23)17-8-10-18(11-9-17)29-14-16-6-4-3-5-7-16/h3-11,19H,2,12,14-15H2,1H3,(H,25,26)InChIKey
PECTYNWEDBHKMF-UHFFFAOYSA-NSynonyms
332046-10-3332046103
CCOC(=O)CSC1=C(C(CC(=O)N1)C2=CC=C(C=C2)OCC3=CC=CC=C3)C#N
ethyl((4(4(benzyloxy)phenyl)3cyano6oxo1456tetrahydropyridin2yl)sulfanyl)acetate
ethyl2((4(4(benzyloxy)phenyl)3cyano6oxo1456tetrahydropyridin2yl)thio)acetate
ETHYL2((5CYANO2OXO4(4PHENYLMETHOXYPHENYL)34DIHYDRO1HPYRIDIN6YL)SULFANYL)ACETATE
InChI=1SC23H22N2O4Sc122822(27)15302320(1324)19(1221(26)2523)1781018(11917)2914166435716h31119H2121415H21H3(H2526)
MFCD01578946
ZINC000009329993
ZINC000009374351
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