N-[(6,7-dimethoxyquinolin-4-yl)oxy-(2-fluorophenyl)carbamothioyl]-2-phenyl-ethanamide

Systemtic Name: N-[(6,7-dimethoxyquinolin-4-yl)oxy-(2-fluorophenyl)carbamothioyl]-2-phenyl-ethanamide Openeye Name: N-[(6,7-dimethoxy-4-quinolyl)oxy-(2-fluorophenyl)carbamothioyl]-2-phenyl-acetamide CAS Name: N-[[N-[(6,7-dimethoxy-4-quinolinyl)oxy]-2-fluoroanilino]-sulfanylidenemethyl]-2-phenylacetamide IUPAC Name: N-[(6,7-dimethoxyquinolin-4-yl)oxy-(2-fluorophenyl)carbamothioyl]-2-phenylacetamide Traditional Name: N-[(6,7-dimethoxy-4-quinolyl)oxy-(2-fluorophenyl)thiocarbamoyl]-2-phenyl-acetamide Formula: C26H22FN3O4S MolecularWeight: 491.533983

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=CN=C2C=C1OC)ON(C3=CC=CC=C3F)C(=S)NC(=O)CC4=CC=CC=C4

Isomeric SMILES

COC1=CC2=C(C=CN=C2C=C1OC)ON(C3=CC=CC=C3F)C(=S)NC(=O)CC4=CC=CC=C4

InChI

InChI=1S/C26H22FN3O4S/c1-32-23-15-18-20(16-24(23)33-2)28-13-12-22(18)34-30(21-11-7-6-10-19(21)27)26(35)29-25(31)14-17-8-4-3-5-9-17/h3-13,15-16H,14H2,1-2H3,(H,29,31,35)