Vitas-M small molecule compound
methyl 4-(2-chlorophenyl)-7-(4-chlorophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK000564
SMILES COC(=O)C1=C(C)NC2=C(C1c1ccccc1Cl)C(=O)CC(C2)c1ccc(cc1)Cl
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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 C24H21Cl2NO3 MW 442.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H21Cl2NO3/c1-13-21(24(29)30-2)22(17-5-3-4-6-18(17)26)23-19(27-13)11-15(12-20(23)28)14-7-9-16(25)10-8-14/h3-10,15,22,27H,11-12H2,1-2H3InChIKey
NICAULMNTWUNIH-UHFFFAOYSA-NSynonyms
5709-92-25709922
CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=C(C=C3)Cl)C4=CC=CC=C4Cl)C(=O)OC
COC(=O)C1=C(C)NC2=C(C1c1ccccc1Cl)C(=O)CC(C2)c1ccc(cc1)Cl
InChI=1SC24H21Cl2NO3c11321(24(29)302)22(17534618(17)26)2319(2713)1115(1220(23)28)147916(25)10814h310152227H1112H212H3
methyl4(2chlorophenyl)7(4chlorophenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
methyl4(2chlorophenyl)7(4chlorophenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
MFCD02632903
STK000564
ZINC000001201879
ZINC000001201889
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