Vitas-M small molecule compound
3-[2-(ethylsulfanyl)ethyl] 6-methyl 4-(4-chloro-3-fluorophenyl)-2,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate
Catalog ID
STK407579
SMILES CCSCCOC(=O)C1=C(C)NC2=C(C1c1ccc(c(c1)F)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 C24H27ClFNO5S MW 496.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H27ClFNO5S/c1-5-33-9-8-32-24(30)19-13(3)27-17-10-12(2)18(23(29)31-4)22(28)21(17)20(19)14-6-7-15(25)16(26)11-14/h6-7,11-12,18,20,27H,5,8-10H2,1-4H3InChIKey
GDALDTMGNWGZOM-UHFFFAOYSA-NSynonyms
3(2(ethylsulfanyl)ethyl)6methyl4(4chloro3fluorophenyl)27dimethyl5oxo145678hexahydroquinoline36dicarboxylate
3O(2ethylsulfanylethyl)6Omethyl4(4chloro3fluorophenyl)27dimethyl5oxo4678tetrahydro1Hquinoline36dicarboxylate
CCSCCOC(=O)C1=C(NC2=C(C1C3=CC(=C(C=C3)Cl)F)C(=O)C(C(C2)C)C(=O)OC)C
InChI=1SC24H27ClFNO5Sc1533983224(30)1913(3)27171012(2)18(23(29)314)22(28)21(17)20(19)146715(25)16(26)1114h671112182027H5810H214H3
MFCD04221599
ZINC000020190434
ZINC000035877312
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