ethyl 2-[[2-(3,4-dichlorophenyl)quinolin-4-yl]carbonylamino]-1-benzothiophene-3-carboxylate

Systemtic Name: ethyl 2-[[2-(3,4-dichlorophenyl)quinolin-4-yl]carbonylamino]-1-benzothiophene-3-carboxylate Openeye Name: ethyl 2-[[2-(3,4-dichlorophenyl)quinoline-4-carbonyl]amino]benzothiophene-3-carboxylate CAS Name: 2-[[[2-(3,4-dichlorophenyl)-4-quinolinyl]-oxomethyl]amino]-1-benzothiophene-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(3,4-dichlorophenyl)quinoline-4-carbonyl]amino]-1-benzothiophene-3-carboxylate Traditional Name: 2-[[2-(3,4-dichlorophenyl)quinoline-4-carbonyl]amino]benzothiophene-3-carboxylic acid ethyl ester Formula: C27H18Cl2N2O3S MolecularWeight: 521.41442

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=CC=CC=C21)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC(=C(C=C5)Cl)Cl

Isomeric SMILES

CCOC(=O)C1=C(SC2=CC=CC=C21)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC(=C(C=C5)Cl)Cl

InChI

InChI=1S/C27H18Cl2N2O3S/c1-2-34-27(33)24-17-8-4-6-10-23(17)35-26(24)31-25(32)18-14-22(15-11-12-19(28)20(29)13-15)30-21-9-5-3-7-16(18)21/h3-14H,2H2,1H3,(H,31,32)