Vitas-M small molecule compound
butyl {[4-(2-chlorophenyl)-3-cyano-6-methyl-5-(phenylcarbamoyl)-1,4-dihydropyridin-2-yl]sulfanyl}acetate
Catalog ID
STK827594
SMILES CCCCOC(=O)CSC1=C(C#N)C(C(=C(N1)C)C(=O)Nc1ccccc1)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 C26H26ClN3O3S MW 496.03 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26ClN3O3S/c1-3-4-14-33-22(31)16-34-26-20(15-28)24(19-12-8-9-13-21(19)27)23(17(2)29-26)25(32)30-18-10-6-5-7-11-18/h5-13,24,29H,3-4,14,16H2,1-2H3,(H,30,32)InChIKey
OJZDOEGINAVTIL-UHFFFAOYSA-NSynonyms
butyl((4(2chlorophenyl)3cyano6methyl5(phenylcarbamoyl)14dihydropyridin2yl)sulfanyl)acetate
BUTYL2((4(2CHLOROPHENYL)3CYANO6METHYL5(PHENYLCARBAMOYL)14DIHYDROPYRIDIN2YL)SULFANYL)ACETATE
CCCCOC(=O)CSC1=C(C(C(=C(N1)C)C(=O)NC2=CC=CC=C2)C3=CC=CC=C3Cl)C#N
InChI=1SC26H26ClN3O3Sc134143322(31)16342620(1528)24(1912891321(19)27)23(17(2)2926)25(32)3018106571118h5132429H341416H212H3(H3032)
MFCD05023273
ZINC000020348516
ZINC000020348518
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