N-[[4-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]carbamothioyl]-3-(trifluoromethyl)benzamide

Systemtic Name: N-[[4-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]carbamothioyl]-3-(trifluoromethyl)benzamide Openeye Name: N-[[4-[(6,7-dimethoxy-4-quinolyl)oxy]phenyl]carbamothioyl]-3-(trifluoromethyl)benzamide CAS Name: N-[[4-[(6,7-dimethoxy-4-quinolinyl)oxy]anilino]-sulfanylidenemethyl]-3-(trifluoromethyl)benzamide IUPAC Name: N-[[4-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]carbamothioyl]-3-(trifluoromethyl)benzamide Traditional Name: N-[[4-[(6,7-dimethoxy-4-quinolyl)oxy]phenyl]thiocarbamoyl]-3-(trifluoromethyl)benzamide Formula: C26H20F3N3O4S MolecularWeight: 527.51491

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=CN=C2C=C1OC)OC3=CC=C(C=C3)NC(=S)NC(=O)C4=CC(=CC=C4)C(F)(F)F

Isomeric SMILES

COC1=CC2=C(C=CN=C2C=C1OC)OC3=CC=C(C=C3)NC(=S)NC(=O)C4=CC(=CC=C4)C(F)(F)F

InChI

InChI=1S/C26H20F3N3O4S/c1-34-22-13-19-20(14-23(22)35-2)30-11-10-21(19)36-18-8-6-17(7-9-18)31-25(37)32-24(33)15-4-3-5-16(12-15)26(27,28)29/h3-14H,1-2H3,(H2,31,32,33,37)