Vitas-M small molecule compound

butyl 4-({[6-bromo-2-(3,4-dimethylphenyl)quinolin-4-yl]carbonyl}amino)benzoate

Catalog ID
STK427249
SMILES CCCCOC(=O)c1ccc(cc1)NC(=O)c1cc(nc2c1cc(Br)cc2)c1ccc(c(c1)C)C

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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 C29H27BrN2O3 MW 531.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H27BrN2O3/c1-4-5-14-35-29(34)20-8-11-23(12-9-20)31-28(33)25-17-27(21-7-6-18(2)19(3)15-21)32-26-13-10-22(30)16-24(25)26/h6-13,15-17H,4-5,14H2,1-3H3,(H,31,33)
InChIKey
NJAQTZLOVQUGCY-UHFFFAOYSA-N
Synonyms

BUTYL4(((6BROMO2(34DIMETHYLPHENYL)4QUINOLINYL)CARBONYL)AMINO)BENZOATE
butyl4(((6bromo2(34dimethylphenyl)quinolin4yl)carbonyl)amino)benzoate
BUTYL4((2(34DIMETHYLPHENYL)6BROMO4QUINOLYL)CARBONYLAMINO)BENZOATE
BUTYL4((6BROMO2(34DIMETHYLPHENYL)QUINOLINE4CARBONYL)AMINO)BENZOATE
CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC(=NC3=C2C=C(C=C3)Br)C4=CC(=C(C=C4)C)C
InChI=1SC29H27BrN2O3c145143529(34)2081123(12920)3128(33)251727(217618(2)19(3)1521)3226131022(30)1624(25)26h6131517H4514H213H3(H3133)
MFCD02612119
ZINC000002105628
ZINC02105628
ZINC2105628

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Available files

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