methyl 4-fluoranyl-3-[(2-thiophen-2-ylquinolin-4-yl)carbonylamino]benzoate

Systemtic Name: methyl 4-fluoranyl-3-[(2-thiophen-2-ylquinolin-4-yl)carbonylamino]benzoate Openeye Name: methyl 4-fluoro-3-[[2-(2-thienyl)quinoline-4-carbonyl]amino]benzoate CAS Name: 4-fluoro-3-[[oxo-(2-thiophen-2-yl-4-quinolinyl)methyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-fluoro-3-[(2-thiophen-2-ylquinoline-4-carbonyl)amino]benzoate Traditional Name: 4-fluoro-3-[[2-(2-thienyl)quinoline-4-carbonyl]amino]benzoic acid methyl ester Formula: C22H15FN2O3S MolecularWeight: 406.429503

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)F)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CS4

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)F)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CS4

InChI

InChI=1S/C22H15FN2O3S/c1-28-22(27)13-8-9-16(23)18(11-13)25-21(26)15-12-19(20-7-4-10-29-20)24-17-6-3-2-5-14(15)17/h2-12H,1H3,(H,25,26)