Vitas-M small molecule compound
2-(ethylsulfanyl)ethyl 4-(2-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK035797
SMILES CCSCCOC(=O)C1=C(C)NC2=C(C1c1ccccc1OC)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 C22H27NO4S MW 401.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27NO4S/c1-4-28-13-12-27-22(25)19-14(2)23-16-9-7-10-17(24)21(16)20(19)15-8-5-6-11-18(15)26-3/h5-6,8,11,20,23H,4,7,9-10,12-13H2,1-3H3InChIKey
WBTYEFXDTNTMAF-UHFFFAOYSA-NSynonyms
2(ethylsulfanyl)ethyl4(2methoxyphenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
2ethylsulfanylethyl4(2methoxyphenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
CCSCCOC(=O)C1=C(C)NC2=C(C1c1ccccc1OC)C(=O)CCC2
CCSCCOC(=O)C1=C(NC2=C(C1C3=CC=CC=C3OC)C(=O)CCC2)C
InChI=1SC22H27NO4Sc142813122722(25)1914(2)2316971017(24)21(16)20(19)158561118(15)263h568112023H479101213H213H3
MFCD01446327
STK035797
ZINC000019770480
ZINC000019770481
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Check stock on Vitas-MAvailable files
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