Vitas-M small molecule compound
cyclohexyl 4-(3-bromo-4-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK022117
SMILES COc1ccc(cc1Br)C1C(=C(C)NC2=C1C(=O)CCC2)C(=O)OC1CCCCC1
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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 C24H28BrNO4 MW 474.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H28BrNO4/c1-14-21(24(28)30-16-7-4-3-5-8-16)22(15-11-12-20(29-2)17(25)13-15)23-18(26-14)9-6-10-19(23)27/h11-13,16,22,26H,3-10H2,1-2H3InChIKey
IKBVXNDSGOZXCS-UHFFFAOYSA-NSynonyms
CC1=C(C(C2=C(N1)CCCC2=O)C3=CC(=C(C=C3)OC)Br)C(=O)OC4CCCCC4
COc1ccc(cc1Br)C1C(=C(C)NC2=C1C(=O)CCC2)C(=O)OC1CCCCC1
cyclohexyl4(3bromo4methoxyphenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
cyclohexyl4(3bromo4methoxyphenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
InChI=1SC24H28BrNO4c11421(24(28)30167435816)22(15111220(292)17(25)1315)2318(2614)961019(23)27h1113162226H310H212H3
MFCD00752949
STK022117
ZINC000019535443
ZINC000019535446
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