Vitas-M small molecule compound
ethyl 6-({2-[(4-chlorophenyl)amino]-2-oxoethyl}sulfanyl)-5-cyano-4-(furan-2-yl)-2-phenyl-1,4-dihydropyridine-3-carboxylate
Catalog ID
STK826732
SMILES CCOC(=O)C1=C(NC(=C(C1c1ccco1)C#N)SCC(=O)Nc1ccc(cc1)Cl)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 C27H22ClN3O4S MW 520.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22ClN3O4S/c1-2-34-27(33)24-23(21-9-6-14-35-21)20(15-29)26(31-25(24)17-7-4-3-5-8-17)36-16-22(32)30-19-12-10-18(28)11-13-19/h3-14,23,31H,2,16H2,1H3,(H,30,32)InChIKey
ZFJWFVBONXUEME-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(NC(=C(C1C2=CC=CO2)C#N)SCC(=O)NC3=CC=C(C=C3)Cl)C4=CC=CC=C4
ethyl6((2((4chlorophenyl)amino)2oxoethyl)sulfanyl)5cyano4(furan2yl)2phenyl14dihydropyridine3carboxylate
ETHYL6(2(4CHLOROANILINO)2OXOETHYL)SULFANYL5CYANO4(FURAN2YL)2PHENYL14DIHYDROPYRIDINE3CARBOXYLATE
InChI=1SC27H22ClN3O4Sc123427(33)2423(2196143521)20(1529)26(3125(24)177435817)361622(32)3019121018(28)111319h3142331H216H21H3(H3032)
MFCD05033540
ZINC000020136757
ZINC000020136760
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