Vitas-M small molecule compound
ethyl 4-(3,5-dichlorothiophen-2-yl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK755280
SMILES CCOC(=O)C1=C(C)NC2=C(C1c1sc(cc1Cl)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 C17H17Cl2NO3S MW 386.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17Cl2NO3S/c1-3-23-17(22)13-8(2)20-10-5-4-6-11(21)14(10)15(13)16-9(18)7-12(19)24-16/h7,15,20H,3-6H2,1-2H3InChIKey
LTDQJIOYDUSQLJ-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(NC2=C(C1C3=C(C=C(S3)Cl)Cl)C(=O)CCC2)C
ethyl4(35dichlorothiophen2yl)2methyl5oxo145678hexahydroquinoline3carboxylate
ethyl4(35dichlorothiophen2yl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
InChI=1SC17H17Cl2NO3Sc132317(22)138(2)201054611(21)14(10)15(13)169(18)712(19)2416h71520H36H212H3
MFCD00827743
ZINC000001445447
ZINC000001445448
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