Vitas-M small molecule compound

methyl 7-(2-chlorophenyl)-4-(4-chlorophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate

Catalog ID
STK375941
SMILES COC(=O)C1=C(C)NC2=C(C1c1ccc(cc1)Cl)C(=O)CC(C2)c1ccccc1Cl

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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(14-7-9-16(25)10-8-14)23-19(27-13)11-15(12-20(23)28)17-5-3-4-6-18(17)26/h3-10,15,22,27H,11-12H2,1-2H3
InChIKey
GJXNZLWSOVVDNT-UHFFFAOYSA-N
Synonyms
5792-69-8
5792698
CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=CC=C3Cl)C4=CC=C(C=C4)Cl)C(=O)OC
InChI=1SC24H21Cl2NO3c11321(24(29)302)22(147916(25)10814)2319(2713)1115(1220(23)28)17534618(17)26h310152227H1112H212H3
methyl7(2chlorophenyl)4(4chlorophenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
methyl7(2chlorophenyl)4(4chlorophenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
MFCD01192081
ZINC000019635426
ZINC000019635436

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.