Vitas-M small molecule compound
cyclohexyl 4-(3-bromo-4-methoxyphenyl)-7-(4-chlorophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK078718
SMILES COc1ccc(cc1Br)C1C(=C(C)NC2=C1C(=O)CC(C2)c1ccc(cc1)Cl)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 C30H31BrClNO4 MW 584.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H31BrClNO4/c1-17-27(30(35)37-22-6-4-3-5-7-22)28(19-10-13-26(36-2)23(31)14-19)29-24(33-17)15-20(16-25(29)34)18-8-11-21(32)12-9-18/h8-14,20,22,28,33H,3-7,15-16H2,1-2H3InChIKey
OOIYOTHDXROHHZ-UHFFFAOYSA-NSynonyms
306285-24-5306285245
CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=C(C=C3)Cl)C4=CC(=C(C=C4)OC)Br)C(=O)OC5CCCCC5
COc1ccc(cc1Br)C1C(=C(C)NC2=C1C(=O)CC(C2)c1ccc(cc1)Cl)C(=O)OC1CCCCC1
cyclohexyl4(3bromo4methoxyphenyl)7(4chlorophenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
cyclohexyl4(3bromo4methoxyphenyl)7(4chlorophenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
InChI=1SC30H31BrClNO4c11727(30(35)37226435722)28(19101326(362)23(31)1419)2924(3317)1520(1625(29)34)1881121(32)12918h81420222833H371516H212H3
MFCD01823971
STK078718
ZINC000002757363
ZINC000002757366
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