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

Systemtic Name: N-[[4-(6,7-dimethoxyquinolin-4-yl)oxy-2-fluoranyl-phenyl]carbamothioyl]-2-(2-methylphenyl)ethanamide Openeye Name: N-[[4-[(6,7-dimethoxy-4-quinolyl)oxy]-2-fluoro-phenyl]carbamothioyl]-2-(o-tolyl)acetamide CAS Name: N-[[4-[(6,7-dimethoxy-4-quinolinyl)oxy]-2-fluoroanilino]-sulfanylidenemethyl]-2-(2-methylphenyl)acetamide IUPAC Name: N-[[4-(6,7-dimethoxyquinolin-4-yl)oxy-2-fluorophenyl]carbamothioyl]-2-(2-methylphenyl)acetamide Traditional Name: N-[[4-[(6,7-dimethoxy-4-quinolyl)oxy]-2-fluoro-phenyl]thiocarbamoyl]-2-(o-tolyl)acetamide Formula: C27H24FN3O4S MolecularWeight: 505.560563

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CC(=O)NC(=S)NC2=C(C=C(C=C2)OC3=C4C=C(C(=CC4=NC=C3)OC)OC)F

Isomeric SMILES

CC1=CC=CC=C1CC(=O)NC(=S)NC2=C(C=C(C=C2)OC3=C4C=C(C(=CC4=NC=C3)OC)OC)F

InChI

InChI=1S/C27H24FN3O4S/c1-16-6-4-5-7-17(16)12-26(32)31-27(36)30-21-9-8-18(13-20(21)28)35-23-10-11-29-22-15-25(34-3)24(33-2)14-19(22)23/h4-11,13-15H,12H2,1-3H3,(H2,30,31,32,36)