methyl 2-[(6-bromanyl-2-phenyl-quinolin-4-yl)carbonylamino]-4-(4-cyclohexylphenyl)thiophene-3-carboxylate

Systemtic Name: methyl 2-[(6-bromanyl-2-phenyl-quinolin-4-yl)carbonylamino]-4-(4-cyclohexylphenyl)thiophene-3-carboxylate Openeye Name: methyl 2-[(6-bromo-2-phenyl-quinoline-4-carbonyl)amino]-4-(4-cyclohexylphenyl)thiophene-3-carboxylate CAS Name: 2-[[(6-bromo-2-phenyl-4-quinolinyl)-oxomethyl]amino]-4-(4-cyclohexylphenyl)-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[(6-bromo-2-phenylquinoline-4-carbonyl)amino]-4-(4-cyclohexylphenyl)thiophene-3-carboxylate Traditional Name: 2-[(6-bromo-2-phenyl-quinoline-4-carbonyl)amino]-4-(4-cyclohexylphenyl)thiophene-3-carboxylic acid methyl ester Formula: C34H29BrN2O3S MolecularWeight: 625.57466

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC=C1C2=CC=C(C=C2)C3CCCCC3)NC(=O)C4=CC(=NC5=C4C=C(C=C5)Br)C6=CC=CC=C6

Isomeric SMILES

COC(=O)C1=C(SC=C1C2=CC=C(C=C2)C3CCCCC3)NC(=O)C4=CC(=NC5=C4C=C(C=C5)Br)C6=CC=CC=C6

InChI

InChI=1S/C34H29BrN2O3S/c1-40-34(39)31-28(23-14-12-22(13-15-23)21-8-4-2-5-9-21)20-41-33(31)37-32(38)27-19-30(24-10-6-3-7-11-24)36-29-17-16-25(35)18-26(27)29/h3,6-7,10-21H,2,4-5,8-9H2,1H3,(H,37,38)