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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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