Vitas-M small molecule compound
2-(ethylsulfanyl)ethyl 2-methyl-4-[4-(methylsulfanyl)phenyl]-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK377272
SMILES CCSCCOC(=O)C1=C(C)NC2=C(C1c1ccc(cc1)SC)C(=O)CCC2
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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 C22H27NO3S2 MW 417.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27NO3S2/c1-4-28-13-12-26-22(25)19-14(2)23-17-6-5-7-18(24)21(17)20(19)15-8-10-16(27-3)11-9-15/h8-11,20,23H,4-7,12-13H2,1-3H3InChIKey
JUYYCDYIYHNPJV-UHFFFAOYSA-NSynonyms
2(ethylsulfanyl)ethyl2methyl4(4(methylsulfanyl)phenyl)5oxo145678hexahydroquinoline3carboxylate
2ethylsulfanylethyl2methyl4(4methylsulfanylphenyl)5oxo4678tetrahydro1Hquinoline3carboxylate
CCSCCOC(=O)C1=C(NC2=C(C1C3=CC=C(C=C3)SC)C(=O)CCC2)C
InChI=1SC22H27NO3S2c142813122622(25)1914(2)231765718(24)21(17)20(19)1581016(273)11915h8112023H471213H213H3
MFCD01461260
ZINC000002926322
ZINC000002926325
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