Vitas-M small molecule compound
2-(ethylsulfanyl)ethyl 4-(4-ethylphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK024530
SMILES CCSCCOC(=O)C1=C(C)NC2=C(C1c1ccc(cc1)CC)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 C23H29NO3S MW 399.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H29NO3S/c1-4-16-9-11-17(12-10-16)21-20(23(26)27-13-14-28-5-2)15(3)24-18-7-6-8-19(25)22(18)21/h9-12,21,24H,4-8,13-14H2,1-3H3InChIKey
HMOKBDBWSBTBET-UHFFFAOYSA-NSynonyms
2(ethylsulfanyl)ethyl4(4ethylphenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
2ethylsulfanylethyl4(4ethylphenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
CCC1=CC=C(C=C1)C2C3=C(CCCC3=O)NC(=C2C(=O)OCCSCC)C
CCSCCOC(=O)C1=C(C)NC2=C(C1c1ccc(cc1)CC)C(=O)CCC2
InChI=1SC23H29NO3Sc141691117(121016)2120(23(26)2713142852)15(3)241876819(25)22(18)21h9122124H481314H213H3
MFCD02375987
STK024530
ZINC000004536306
ZINC000004536307
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