Vitas-M small molecule compound
5-cyano-6-({2-[(2,4-dimethylphenyl)amino]-2-oxoethyl}sulfanyl)-4-(4-ethoxyphenyl)-2-methyl-N-phenyl-1,4-dihydropyridine-3-carboxamide
Catalog ID
STK550747
SMILES CCOc1ccc(cc1)C1C(=C(SCC(=O)Nc2ccc(cc2C)C)NC(=C1C(=O)Nc1ccccc1)C)C#N
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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 C32H32N4O3S MW 552.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H32N4O3S/c1-5-39-25-14-12-23(13-15-25)30-26(18-33)32(40-19-28(37)36-27-16-11-20(2)17-21(27)3)34-22(4)29(30)31(38)35-24-9-7-6-8-10-24/h6-17,30,34H,5,19H2,1-4H3,(H,35,38)(H,36,37)InChIKey
KWKRCHBERKSLDZ-UHFFFAOYSA-NSynonyms
5cyano6((2((24dimethylphenyl)amino)2oxoethyl)sulfanyl)4(4ethoxyphenyl)2methylNphenyl14dihydropyridine3carboxamide
5cyano6((2((24dimethylphenyl)amino)2oxoethyl)thio)4(4ethoxyphenyl)2methylNphenyl14dihydropyridine3carboxamide
5CYANO6(2(24DIMETHYLANILINO)2OXOETHYL)SULFANYL4(4ETHOXYPHENYL)2METHYLNPHENYL14DIHYDROPYRIDINE3CARBOXAMIDE
CCOC1=CC=C(C=C1)C2C(=C(NC(=C2C(=O)NC3=CC=CC=C3)C)SCC(=O)NC4=C(C=C(C=C4)C)C)C#N
InChI=1SC32H32N4O3Sc153925141223(131525)3026(1833)32(401928(37)3627161120(2)1721(27)3)3422(4)29(30)31(38)352497681024h6173034H519H214H3(H3538)(H3637)
MFCD03679376
ZINC000002591612
ZINC000098000316
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