Vitas-M small molecule compound
ethyl 5-cyano-4-(furan-2-yl)-6-({2-[(2-methylphenyl)amino]-2-oxoethyl}sulfanyl)-2-phenyl-1,4-dihydropyridine-3-carboxylate
Catalog ID
STK844384
SMILES CCOC(=O)C1=C(NC(=C(C1c1ccco1)C#N)SCC(=O)Nc1ccccc1C)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 C28H25N3O4S MW 499.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H25N3O4S/c1-3-34-28(33)25-24(22-14-9-15-35-22)20(16-29)27(31-26(25)19-11-5-4-6-12-19)36-17-23(32)30-21-13-8-7-10-18(21)2/h4-15,24,31H,3,17H2,1-2H3,(H,30,32)InChIKey
LSGHYHPCJQMZLI-UHFFFAOYSA-NSynonyms
687592-05-8687592058
CCOC(=O)C1=C(NC(=C(C1C2=CC=CO2)C#N)SCC(=O)NC3=CC=CC=C3C)C4=CC=CC=C4
ETHYL5CYANO4(2FURYL)6((2OXO2(2TOLUIDINO)ETHYL)SULFANYL)2PHENYL14DIHYDRO3PYRIDINECARBOXYLATE
ethyl5cyano4(furan2yl)6((2((2methylphenyl)amino)2oxoethyl)sulfanyl)2phenyl14dihydropyridine3carboxylate
ethyl5cyano4(furan2yl)6((2oxo2(otolylamino)ethyl)thio)2phenyl14dihydropyridine3carboxylate
ETHYL5CYANO4(FURAN2YL)6(2(2METHYLANILINO)2OXOETHYL)SULFANYL2PHENYL14DIHYDROPYRIDINE3CARBOXYLATE
InChI=1SC28H25N3O4Sc133428(33)2524(22149153522)20(1629)27(3126(25)19115461219)361723(32)302113871018(21)2h4152431H317H212H3(H3032)
MFCD03671661
ZINC000002204313
ZINC000002204315
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