Vitas-M small molecule compound

2-methoxyethyl 4-(4-chlorophenyl)-5-cyano-2-methyl-6-{[2-oxo-2-(phenylamino)ethyl]sulfanyl}-1,4-dihydropyridine-3-carboxylate

Catalog ID
STK549338
SMILES COCCOC(=O)C1=C(C)NC(=C(C1c1ccc(cc1)Cl)C#N)SCC(=O)Nc1ccccc1

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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 C25H24ClN3O4S MW 498.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24ClN3O4S/c1-16-22(25(31)33-13-12-32-2)23(17-8-10-18(26)11-9-17)20(14-27)24(28-16)34-15-21(30)29-19-6-4-3-5-7-19/h3-11,23,28H,12-13,15H2,1-2H3,(H,29,30)
InChIKey
COSFFMOEOBYXQT-UHFFFAOYSA-N
Synonyms
799771-88-3
2methoxyethyl4(4chlorophenyl)5cyano2methyl6((2oxo2(phenylamino)ethyl)sulfanyl)14dihydropyridine3carboxylate
2methoxyethyl4(4chlorophenyl)5cyano2methyl6((2oxo2(phenylamino)ethyl)thio)14dihydropyridine3carboxylate
2METHOXYETHYL6(2ANILINO2OXOETHYL)SULFANYL4(4CHLOROPHENYL)5CYANO2METHYL14DIHYDROPYRIDINE3CARBOXYLATE
799771883
CC1=C(C(C(=C(N1)SCC(=O)NC2=CC=CC=C2)C#N)C3=CC=C(C=C3)Cl)C(=O)OCCOC
InChI=1SC25H24ClN3O4Sc11622(25(31)331312322)23(1781018(26)11917)20(1427)24(2816)341521(30)29196435719h3112328H121315H212H3(H2930)
MFCD03672053
ZINC000020170760
ZINC000020170762

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.