methyl 5-phenyl-2-[(2-pyridin-4-ylquinolin-4-yl)carbonylamino]thiophene-3-carboxylate

Systemtic Name: methyl 5-phenyl-2-[(2-pyridin-4-ylquinolin-4-yl)carbonylamino]thiophene-3-carboxylate Openeye Name: methyl 5-phenyl-2-[[2-(4-pyridyl)quinoline-4-carbonyl]amino]thiophene-3-carboxylate CAS Name: 2-[[oxo-(2-pyridin-4-yl-4-quinolinyl)methyl]amino]-5-phenyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-phenyl-2-[(2-pyridin-4-ylquinoline-4-carbonyl)amino]thiophene-3-carboxylate Traditional Name: 5-phenyl-2-[[2-(4-pyridyl)quinoline-4-carbonyl]amino]thiophene-3-carboxylic acid methyl ester Formula: C27H19N3O3S MolecularWeight: 465.52306

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H19N3O3S/c1-33-27(32)21-16-24(18-7-3-2-4-8-18)34-26(21)30-25(31)20-15-23(17-11-13-28-14-12-17)29-22-10-6-5-9-19(20)22/h2-16H,1H3,(H,30,31)