ethyl 5-[(2-pyridin-2-ylquinolin-4-yl)carbonylamino]thiophene-2-carboxylate

Systemtic Name: ethyl 5-[(2-pyridin-2-ylquinolin-4-yl)carbonylamino]thiophene-2-carboxylate Openeye Name: ethyl 5-[[2-(2-pyridyl)quinoline-4-carbonyl]amino]thiophene-2-carboxylate CAS Name: 5-[[oxo-[2-(2-pyridinyl)-4-quinolinyl]methyl]amino]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[(2-pyridin-2-ylquinoline-4-carbonyl)amino]thiophene-2-carboxylate Traditional Name: 5-[[2-(2-pyridyl)quinoline-4-carbonyl]amino]thiophene-2-carboxylic acid ethyl ester Formula: C22H17N3O3S MolecularWeight: 403.45368

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(S1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CC=N4

Isomeric SMILES

CCOC(=O)C1=CC=C(S1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CC=N4

InChI

InChI=1S/C22H17N3O3S/c1-2-28-22(27)19-10-11-20(29-19)25-21(26)15-13-18(17-9-5-6-12-23-17)24-16-8-4-3-7-14(15)16/h3-13H,2H2,1H3,(H,25,26)