Vitas-M small molecule compound
ethyl 4-{[(5-cyano-2-methyl-6-{[2-(4-methylphenyl)-2-oxoethyl]sulfanyl}-4-phenyl-1,4-dihydropyridin-3-yl)carbonyl]amino}benzoate
Catalog ID
STK885682
SMILES CCOC(=O)c1ccc(cc1)NC(=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 C32H29N3O4S MW 551.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H29N3O4S/c1-4-39-32(38)24-14-16-25(17-15-24)35-30(37)28-21(3)34-31(26(18-33)29(28)23-8-6-5-7-9-23)40-19-27(36)22-12-10-20(2)11-13-22/h5-17,29,34H,4,19H2,1-3H3,(H,35,37)InChIKey
KUIGREYAWSMLNU-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=C(NC(=C(C2C3=CC=CC=C3)C#N)SCC(=O)C4=CC=C(C=C4)C)C
ethyl4(((5cyano2methyl6((2(4methylphenyl)2oxoethyl)sulfanyl)4phenyl14dihydropyridin3yl)carbonyl)amino)benzoate
ethyl4((5cyano2methyl6(2(4methylphenyl)2oxoethyl)sulfanyl4phenyl14dihydropyridine3carbonyl)amino)benzoate
InChI=1SC32H29N3O4Sc143932(38)24141625(171524)3530(37)2821(3)3431(26(1833)29(28)238657923)401927(36)22121020(2)111322h5172934H419H213H3(H3537)
MFCD10086226
ZINC000098048891
ZINC000098048892
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