ethyl 4-(4-chlorophenyl)-2-[(2-thiophen-2-ylquinolin-4-yl)carbonylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4-(4-chlorophenyl)-2-[(2-thiophen-2-ylquinolin-4-yl)carbonylamino]thiophene-3-carboxylate Openeye Name: ethyl 4-(4-chlorophenyl)-2-[[2-(2-thienyl)quinoline-4-carbonyl]amino]thiophene-3-carboxylate CAS Name: 4-(4-chlorophenyl)-2-[[oxo-(2-thiophen-2-yl-4-quinolinyl)methyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-chlorophenyl)-2-[(2-thiophen-2-ylquinoline-4-carbonyl)amino]thiophene-3-carboxylate Traditional Name: 4-(4-chlorophenyl)-2-[[2-(2-thienyl)quinoline-4-carbonyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C27H19ClN2O3S2 MolecularWeight: 519.03436

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H19ClN2O3S2/c1-2-33-27(32)24-20(16-9-11-17(28)12-10-16)15-35-26(24)30-25(31)19-14-22(23-8-5-13-34-23)29-21-7-4-3-6-18(19)21/h3-15H,2H2,1H3,(H,30,31)