Vitas-M small molecule compound
ethyl ({4-(2-chlorophenyl)-5-[(4-chlorophenyl)carbamoyl]-3-cyano-6-methyl-1,4-dihydropyridin-2-yl}sulfanyl)acetate
Catalog ID
STL337780
SMILES CCOC(=O)CSC1=C(C#N)C(C(=C(N1)C)C(=O)Nc1ccc(cc1)Cl)c1ccccc1Cl
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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 C24H21Cl2N3O3S MW 502.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H21Cl2N3O3S/c1-3-32-20(30)13-33-24-18(12-27)22(17-6-4-5-7-19(17)26)21(14(2)28-24)23(31)29-16-10-8-15(25)9-11-16/h4-11,22,28H,3,13H2,1-2H3,(H,29,31)InChIKey
NYRUHUPBIVJKGD-UHFFFAOYSA-NSynonyms
476210-12-5476210125
CCOC(=O)CSC1=C(C(C(=C(N1)C)C(=O)NC2=CC=C(C=C2)Cl)C3=CC=CC=C3Cl)C#N
ethyl((4(2chlorophenyl)5((4chlorophenyl)carbamoyl)3cyano6methyl14dihydropyridin2yl)sulfanyl)acetate
ETHYL2((4(2CHLOROPHENYL)5((4CHLOROPHENYL)CARBAMOYL)3CYANO6METHYL14DIHYDROPYRIDIN2YL)SULFANYL)ACETATE
ETHYL2((4(2CHLOROPHENYL)5((4CHLOROPHENYL)CARBAMOYL)3CYANO6METHYL14DIHYDROPYRIDIN2YL)THIO)ACETATE
InChI=1SC24H21Cl2N3O3Sc133220(30)13332418(1227)22(17645719(17)26)21(14(2)2824)23(31)291610815(25)91116h4112228H313H212H3(H2931)
MFCD01579067
ZINC000020189295
ZINC000020189298
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