Vitas-M small molecule compound
ethyl 5-cyano-4-(furan-2-yl)-6-{[2-oxo-2-(phenylamino)ethyl]sulfanyl}-2-phenyl-1,4-dihydropyridine-3-carboxylate
Catalog ID
STK826591
SMILES CCOC(=O)C1=C(NC(=C(C1c1ccco1)C#N)SCC(=O)Nc1ccccc1)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 C27H23N3O4S MW 485.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23N3O4S/c1-2-33-27(32)24-23(21-14-9-15-34-21)20(16-28)26(30-25(24)18-10-5-3-6-11-18)35-17-22(31)29-19-12-7-4-8-13-19/h3-15,23,30H,2,17H2,1H3,(H,29,31)InChIKey
LBWCAADLMJDIJR-UHFFFAOYSA-NSynonyms
796879-75-9796879759
CCOC(=O)C1=C(NC(=C(C1C2=CC=CO2)C#N)SCC(=O)NC3=CC=CC=C3)C4=CC=CC=C4
ethyl5cyano4(furan2yl)6((2oxo2(phenylamino)ethyl)sulfanyl)2phenyl14dihydropyridine3carboxylate
ethyl5cyano4(furan2yl)6((2oxo2(phenylamino)ethyl)thio)2phenyl14dihydropyridine3carboxylate
ETHYL6(2ANILINO2OXOETHYL)SULFANYL5CYANO4(FURAN2YL)2PHENYL14DIHYDROPYRIDINE3CARBOXYLATE
InChI=1SC27H23N3O4Sc123327(32)2423(21149153421)20(1628)26(3025(24)18105361118)351722(31)2919127481319h3152330H217H21H3(H2931)
MFCD03670027
ZINC000002201328
ZINC000002201329
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