Vitas-M small molecule compound
ethyl 4-(2-chlorophenyl)-5-cyano-6-{[2-(3,4-dihydroquinolin-1(2H)-yl)-2-oxoethyl]sulfanyl}-2-methyl-1,4-dihydropyridine-3-carboxylate
Catalog ID
STK843199
SMILES CCOC(=O)C1=C(C)NC(=C(C1c1ccccc1Cl)C#N)SCC(=O)N1CCCc2c1cccc2
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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 C27H26ClN3O3S MW 508.04 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26ClN3O3S/c1-3-34-27(33)24-17(2)30-26(20(15-29)25(24)19-11-5-6-12-21(19)28)35-16-23(32)31-14-8-10-18-9-4-7-13-22(18)31/h4-7,9,11-13,25,30H,3,8,10,14,16H2,1-2H3InChIKey
KHZWLFBKYHKNKY-UHFFFAOYSA-NSynonyms
380461-89-2380461892
CCOC(=O)C1=C(NC(=C(C1C2=CC=CC=C2Cl)C#N)SCC(=O)N3CCCC4=CC=CC=C43)C
ethyl4(2chlorophenyl)5cyano6((2(34dihydroquinolin1(2H)yl)2oxoethyl)sulfanyl)2methyl14dihydropyridine3carboxylate
ETHYL4(2CHLOROPHENYL)5CYANO6((2(34DIHYDROQUINOLIN1(2H)YL)2OXOETHYL)THIO)2METHYL14DIHYDROPYRIDINE3CARBOXYLATE
ETHYL4(2CHLOROPHENYL)5CYANO6(2(34DIHYDRO2HQUINOLIN1YL)2OXOETHYL)SULFANYL2METHYL14DIHYDROPYRIDINE3CARBOXYLATE
InChI=1SC27H26ClN3O3Sc133427(33)2417(2)3026(20(1529)25(24)1911561221(19)28)351623(32)3114810189471322(18)31h47911132530H38101416H212H3
MFCD03153968
ZINC000020131708
ZINC000020131712
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