methyl 4-(4-bromophenyl)-2-[(2-thiophen-2-ylquinolin-4-yl)carbonylamino]thiophene-3-carboxylate

Systemtic Name: methyl 4-(4-bromophenyl)-2-[(2-thiophen-2-ylquinolin-4-yl)carbonylamino]thiophene-3-carboxylate Openeye Name: methyl 4-(4-bromophenyl)-2-[[2-(2-thienyl)quinoline-4-carbonyl]amino]thiophene-3-carboxylate CAS Name: 4-(4-bromophenyl)-2-[[oxo-(2-thiophen-2-yl-4-quinolinyl)methyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-(4-bromophenyl)-2-[(2-thiophen-2-ylquinoline-4-carbonyl)amino]thiophene-3-carboxylate Traditional Name: 4-(4-bromophenyl)-2-[[2-(2-thienyl)quinoline-4-carbonyl]amino]thiophene-3-carboxylic acid methyl ester Formula: C26H17BrN2O3S2 MolecularWeight: 549.45878

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC=C1C2=CC=C(C=C2)Br)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CS5

Isomeric SMILES

COC(=O)C1=C(SC=C1C2=CC=C(C=C2)Br)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CS5

InChI

InChI=1S/C26H17BrN2O3S2/c1-32-26(31)23-19(15-8-10-16(27)11-9-15)14-34-25(23)29-24(30)18-13-21(22-7-4-12-33-22)28-20-6-3-2-5-17(18)20/h2-14H,1H3,(H,29,30)