ethyl 2-[[6-bromanyl-2-(3-methylphenyl)quinolin-4-yl]carbonylamino]-5-methyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[[6-bromanyl-2-(3-methylphenyl)quinolin-4-yl]carbonylamino]-5-methyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[6-bromo-2-(m-tolyl)quinoline-4-carbonyl]amino]-5-methyl-thiophene-3-carboxylate CAS Name: 2-[[[6-bromo-2-(3-methylphenyl)-4-quinolinyl]-oxomethyl]amino]-5-methyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[6-bromo-2-(3-methylphenyl)quinoline-4-carbonyl]amino]-5-methylthiophene-3-carboxylate Traditional Name: 2-[[6-bromo-2-(m-tolyl)quinoline-4-carbonyl]amino]-5-methyl-thiophene-3-carboxylic acid ethyl ester Formula: C25H21BrN2O3S MolecularWeight: 509.41484

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1)C)NC(=O)C2=CC(=NC3=C2C=C(C=C3)Br)C4=CC(=CC=C4)C

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1)C)NC(=O)C2=CC(=NC3=C2C=C(C=C3)Br)C4=CC(=CC=C4)C

InChI

InChI=1S/C25H21BrN2O3S/c1-4-31-25(30)20-11-15(3)32-24(20)28-23(29)19-13-22(16-7-5-6-14(2)10-16)27-21-9-8-17(26)12-18(19)21/h5-13H,4H2,1-3H3,(H,28,29)