Vitas-M small molecule compound
2-methoxyethyl 6-{[2-(benzylamino)-2-oxoethyl]sulfanyl}-4-(4-chlorophenyl)-5-cyano-2-methyl-1,4-dihydropyridine-3-carboxylate
Catalog ID
STK549518
SMILES COCCOC(=O)C1=C(C)NC(=C(C1c1ccc(cc1)Cl)C#N)SCC(=O)NCc1ccccc1
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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 C26H26ClN3O4S MW 512.03 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26ClN3O4S/c1-17-23(26(32)34-13-12-33-2)24(19-8-10-20(27)11-9-19)21(14-28)25(30-17)35-16-22(31)29-15-18-6-4-3-5-7-18/h3-11,24,30H,12-13,15-16H2,1-2H3,(H,29,31)InChIKey
DAPITPHCQSXKGF-UHFFFAOYSA-NSynonyms
799773-01-62methoxyethyl6((2(benzylamino)2oxoethyl)sulfanyl)4(4chlorophenyl)5cyano2methyl14dihydropyridine3carboxylate
2methoxyethyl6((2(benzylamino)2oxoethyl)thio)4(4chlorophenyl)5cyano2methyl14dihydropyridine3carboxylate
2METHOXYETHYL6(2(BENZYLAMINO)2OXOETHYL)SULFANYL4(4CHLOROPHENYL)5CYANO2METHYL14DIHYDROPYRIDINE3CARBOXYLATE
799773016
CC1=C(C(C(=C(N1)SCC(=O)NCC2=CC=CC=C2)C#N)C3=CC=C(C=C3)Cl)C(=O)OCCOC
InChI=1SC26H26ClN3O4Sc11723(26(32)341312332)24(1981020(27)11919)21(1428)25(3017)351622(31)2915186435718h3112430H12131516H212H3(H2931)
MFCD03672475
ZINC000002206649
ZINC000020170836
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