N-[(6,7-dimethoxyquinolin-4-yl)oxy-(3-fluorophenyl)carbamothioyl]-2-iodanyl-benzamide

Systemtic Name: N-[(6,7-dimethoxyquinolin-4-yl)oxy-(3-fluorophenyl)carbamothioyl]-2-iodanyl-benzamide Openeye Name: N-[(6,7-dimethoxy-4-quinolyl)oxy-(3-fluorophenyl)carbamothioyl]-2-iodo-benzamide CAS Name: N-[[N-[(6,7-dimethoxy-4-quinolinyl)oxy]-3-fluoroanilino]-sulfanylidenemethyl]-2-iodobenzamide IUPAC Name: N-[(6,7-dimethoxyquinolin-4-yl)oxy-(3-fluorophenyl)carbamothioyl]-2-iodobenzamide Traditional Name: N-[(6,7-dimethoxy-4-quinolyl)oxy-(3-fluorophenyl)thiocarbamoyl]-2-iodo-benzamide Formula: C25H19FIN3O4S MolecularWeight: 603.403933

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=CN=C2C=C1OC)ON(C3=CC(=CC=C3)F)C(=S)NC(=O)C4=CC=CC=C4I

Isomeric SMILES

COC1=CC2=C(C=CN=C2C=C1OC)ON(C3=CC(=CC=C3)F)C(=S)NC(=O)C4=CC=CC=C4I

InChI

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