Vitas-M small molecule compound
2-(ethylsulfanyl)ethyl 4-(3-chlorophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK061002
SMILES CCSCCOC(=O)C1=C(C)NC2=C(C1c1cccc(c1)Cl)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 C21H24ClNO3S MW 405.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24ClNO3S/c1-3-27-11-10-26-21(25)18-13(2)23-16-8-5-9-17(24)20(16)19(18)14-6-4-7-15(22)12-14/h4,6-7,12,19,23H,3,5,8-11H2,1-2H3InChIKey
PLMPOXTZTXYWJL-UHFFFAOYSA-NSynonyms
329073-47-42(ethylsulfanyl)ethyl4(3chlorophenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
2ethylsulfanylethyl4(3chlorophenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
329073474
CCSCCOC(=O)C1=C(C)NC2=C(C1c1cccc(c1)Cl)C(=O)CCC2
CCSCCOC(=O)C1=C(NC2=C(C1C3=CC(=CC=C3)Cl)C(=O)CCC2)C
InChI=1SC21H24ClNO3Sc132711102621(25)1813(2)231685917(24)20(16)19(18)1464715(22)1214h467121923H35811H212H3
MFCD01446380
STK061002
ZINC000002757922
ZINC000002757923
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