Vitas-M small molecule compound
prop-2-en-1-yl 4-(2-chlorophenyl)-5-cyano-2-methyl-6-{[2-(4-methylphenyl)-2-oxoethyl]sulfanyl}-1,4-dihydropyridine-3-carboxylate
Catalog ID
STK826600
SMILES C=CCOC(=O)C1=C(C)NC(=C(C1c1ccccc1Cl)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 C26H23ClN2O3S MW 479.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23ClN2O3S/c1-4-13-32-26(31)23-17(3)29-25(33-15-22(30)18-11-9-16(2)10-12-18)20(14-28)24(23)19-7-5-6-8-21(19)27/h4-12,24,29H,1,13,15H2,2-3H3InChIKey
ZIYFHZIVHUGPMN-UHFFFAOYSA-NSynonyms
CC1=CC=C(C=C1)C(=O)CSC2=C(C(C(=C(N2)C)C(=O)OCC=C)C3=CC=CC=C3Cl)C#N
InChI=1SC26H23ClN2O3Sc14133226(31)2317(3)2925(331522(30)1811916(2)101218)20(1428)24(23)19756821(19)27h4122429H11315H223H3
MFCD10086568
prop2en1yl4(2chlorophenyl)5cyano2methyl6((2(4methylphenyl)2oxoethyl)sulfanyl)14dihydropyridine3carboxylate
prop2enyl4(2chlorophenyl)5cyano2methyl6(2(4methylphenyl)2oxoethyl)sulfanyl14dihydropyridine3carboxylate
ZINC000020347826
ZINC000020347828
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