Vitas-M small molecule compound
prop-2-en-1-yl 5-cyano-2-methyl-6-{[2-(4-methylphenyl)-2-oxoethyl]sulfanyl}-4-phenyl-1,4-dihydropyridine-3-carboxylate
Catalog ID
STK886014
SMILES C=CCOC(=O)C1=C(C)NC(=C(C1c1ccccc1)C#N)SCC(=O)c1ccc(cc1)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 C26H24N2O3S MW 444.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H24N2O3S/c1-4-14-31-26(30)23-18(3)28-25(21(15-27)24(23)20-8-6-5-7-9-20)32-16-22(29)19-12-10-17(2)11-13-19/h4-13,24,28H,1,14,16H2,2-3H3InChIKey
HIHZYAPOOMLRPG-UHFFFAOYSA-NSynonyms
CC1=CC=C(C=C1)C(=O)CSC2=C(C(C(=C(N2)C)C(=O)OCC=C)C3=CC=CC=C3)C#N
InChI=1SC26H24N2O3Sc14143126(30)2318(3)2825(21(1527)24(23)208657920)321622(29)19121017(2)111319h4132428H11416H223H3
MFCD10086552
prop2en1yl5cyano2methyl6((2(4methylphenyl)2oxoethyl)sulfanyl)4phenyl14dihydropyridine3carboxylate
prop2enyl5cyano2methyl6(2(4methylphenyl)2oxoethyl)sulfanyl4phenyl14dihydropyridine3carboxylate
ZINC000020347806
ZINC000020347807
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