N-[[4-(6,7-dimethoxyquinolin-4-yl)oxy-3-fluoranyl-phenyl]carbamothioyl]-4-iodanyl-benzamide

Systemtic Name: N-[[4-(6,7-dimethoxyquinolin-4-yl)oxy-3-fluoranyl-phenyl]carbamothioyl]-4-iodanyl-benzamide Openeye Name: N-[[4-[(6,7-dimethoxy-4-quinolyl)oxy]-3-fluoro-phenyl]carbamothioyl]-4-iodo-benzamide CAS Name: N-[[4-[(6,7-dimethoxy-4-quinolinyl)oxy]-3-fluoroanilino]-sulfanylidenemethyl]-4-iodobenzamide IUPAC Name: N-[[4-(6,7-dimethoxyquinolin-4-yl)oxy-3-fluorophenyl]carbamothioyl]-4-iodobenzamide Traditional Name: N-[[4-[(6,7-dimethoxy-4-quinolyl)oxy]-3-fluoro-phenyl]thiocarbamoyl]-4-iodo-benzamide Formula: C25H19FIN3O4S MolecularWeight: 603.403933

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H19FIN3O4S/c1-32-22-12-17-19(13-23(22)33-2)28-10-9-20(17)34-21-8-7-16(11-18(21)26)29-25(35)30-24(31)14-3-5-15(27)6-4-14/h3-13H,1-2H3,(H2,29,30,31,35)