Vitas-M small molecule compound
3-[2-(ethylsulfanyl)ethyl] 6-methyl 4-(2,3-dichlorophenyl)-2,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate
Catalog ID
STK407426
SMILES CCSCCOC(=O)C1=C(C)NC2=C(C1c1cccc(c1Cl)Cl)C(=O)C(C(C2)C)C(=O)OC
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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 C24H27Cl2NO5S MW 512.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H27Cl2NO5S/c1-5-33-10-9-32-24(30)18-13(3)27-16-11-12(2)17(23(29)31-4)22(28)20(16)19(18)14-7-6-8-15(25)21(14)26/h6-8,12,17,19,27H,5,9-11H2,1-4H3InChIKey
MDVYDMKNFOHHPQ-UHFFFAOYSA-NSynonyms
3(2(ethylsulfanyl)ethyl)6methyl4(23dichlorophenyl)27dimethyl5oxo145678hexahydroquinoline36dicarboxylate
3O(2ethylsulfanylethyl)6Omethyl4(23dichlorophenyl)27dimethyl5oxo4678tetrahydro1Hquinoline36dicarboxylate
CCSCCOC(=O)C1=C(NC2=C(C1C3=C(C(=CC=C3)Cl)Cl)C(=O)C(C(C2)C)C(=O)OC)C
InChI=1SC24H27Cl2NO5Sc15331093224(30)1813(3)27161112(2)17(23(29)314)22(28)20(16)19(18)1476815(25)21(14)26h6812171927H5911H214H3
MFCD04057075
ZINC000020190844
ZINC000035329196
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