Vitas-M small molecule compound
5-cyano-N-(2,6-dimethylphenyl)-4-(furan-2-yl)-2-methyl-6-{[2-oxo-2-(phenylamino)ethyl]sulfanyl}-1,4-dihydropyridine-3-carboxamide
Catalog ID
STK885833
SMILES N#CC1=C(SCC(=O)Nc2ccccc2)NC(=C(C1c1ccco1)C(=O)Nc1c(C)cccc1C)C
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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 C28H26N4O3S MW 498.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H26N4O3S/c1-17-9-7-10-18(2)26(17)32-27(34)24-19(3)30-28(21(15-29)25(24)22-13-8-14-35-22)36-16-23(33)31-20-11-5-4-6-12-20/h4-14,25,30H,16H2,1-3H3,(H,31,33)(H,32,34)InChIKey
YEOAHUBMXRDFDS-UHFFFAOYSA-NSynonyms
5cyanoN(26dimethylphenyl)4(furan2yl)2methyl6((2oxo2(phenylamino)ethyl)sulfanyl)14dihydropyridine3carboxamide
6(2anilino2oxoethyl)sulfanyl5cyanoN(26dimethylphenyl)4(furan2yl)2methyl14dihydropyridine3carboxamide
CC1=C(C(=CC=C1)C)NC(=O)C2=C(NC(=C(C2C3=CC=CO3)C#N)SCC(=O)NC4=CC=CC=C4)C
InChI=1SC28H26N4O3Sc117971018(2)26(17)3227(34)2419(3)3028(21(1529)25(24)22138143522)361623(33)3120115461220h4142530H16H213H3(H3133)(H3234)
MFCD10086369
ZINC000012250161
ZINC000012250162
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