Vitas-M small molecule compound
prop-2-en-1-yl 5-cyano-6-[(2-ethoxy-2-oxoethyl)sulfanyl]-2-methyl-4-(4-methylphenyl)-1,4-dihydropyridine-3-carboxylate
Catalog ID
STK841566
SMILES C=CCOC(=O)C1=C(C)NC(=C(C1c1ccc(cc1)C)C#N)SCC(=O)OCC
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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 C22H24N2O4S MW 412.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24N2O4S/c1-5-11-28-22(26)19-15(4)24-21(29-13-18(25)27-6-2)17(12-23)20(19)16-9-7-14(3)8-10-16/h5,7-10,20,24H,1,6,11,13H2,2-4H3InChIKey
PUBYFPOPTOMPNB-UHFFFAOYSA-NSynonyms
442556-20-9442556209
5CYANO6ETHOXYCARBONYLMETHYLSULFANYL2METHYL4PTOLYL14DIHYDROPYRIDINE3CARBOXYLICACIDALLYLESTER
ALLYL5CYANO6((2ETHOXY2OXOETHYL)THIO)2METHYL4(PTOLYL)14DIHYDROPYRIDINE3CARBOXYLATE
CCOC(=O)CSC1=C(C(C(=C(N1)C)C(=O)OCC=C)C2=CC=C(C=C2)C)C#N
InChI=1SC22H24N2O4Sc15112822(26)1915(4)2421(291318(25)2762)17(1223)20(19)169714(3)81016h57102024H161113H224H3
MFCD03293356
prop2en1yl5cyano6((2ethoxy2oxoethyl)sulfanyl)2methyl4(4methylphenyl)14dihydropyridine3carboxylate
PROP2ENYL5CYANO6(2ETHOXY2OXOETHYL)SULFANYL2METHYL4(4METHYLPHENYL)14DIHYDROPYRIDINE3CARBOXYLATE
ZINC000100853716
ZINC000100853720
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