Vitas-M small molecule compound
butyl {[3-cyano-6-methyl-5-(phenylcarbamoyl)-4-(thiophen-2-yl)-1,4-dihydropyridin-2-yl]sulfanyl}acetate
Catalog ID
STK997604
SMILES CCCCOC(=O)CSC1=C(C#N)C(C(=C(N1)C)C(=O)Nc1ccccc1)c1cccs1
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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 C24H25N3O3S2 MW 467.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H25N3O3S2/c1-3-4-12-30-20(28)15-32-24-18(14-25)22(19-11-8-13-31-19)21(16(2)26-24)23(29)27-17-9-6-5-7-10-17/h5-11,13,22,26H,3-4,12,15H2,1-2H3,(H,27,29)InChIKey
TXIHEFFVFAPPCV-UHFFFAOYSA-NSynonyms
683793-93-3683793933
butyl((3cyano6methyl5(phenylcarbamoyl)4(thiophen2yl)14dihydropyridin2yl)sulfanyl)acetate
BUTYL2((3CYANO6METHYL5(PHENYLCARBAMOYL)4(THIOPHEN2YL)14DIHYDROPYRIDIN2YL)THIO)ACETATE
BUTYL2((3CYANO6METHYL5(PHENYLCARBAMOYL)4THIOPHEN2YL14DIHYDROPYRIDIN2YL)SULFANYL)ACETATE
CCCCOC(=O)CSC1=C(C(C(=C(N1)C)C(=O)NC2=CC=CC=C2)C3=CC=CS3)C#N
InChI=1SC24H25N3O3S2c134123020(28)15322418(1425)22(19118133119)21(16(2)2624)23(29)271796571017h511132226H341215H212H3(H2729)
MFCD03678008
ZINC000020188369
ZINC000020188375
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