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

Systemtic Name: 3-bromanyl-N-[[4-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]carbamothioyl]benzamide Openeye Name: 3-bromo-N-[[4-[(6,7-dimethoxy-4-quinolyl)oxy]phenyl]carbamothioyl]benzamide CAS Name: 3-bromo-N-[[4-[(6,7-dimethoxy-4-quinolinyl)oxy]anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 3-bromo-N-[[4-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]carbamothioyl]benzamide Traditional Name: 3-bromo-N-[[4-[(6,7-dimethoxy-4-quinolyl)oxy]phenyl]thiocarbamoyl]benzamide Formula: C25H20BrN3O4S MolecularWeight: 538.413

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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)Br

Isomeric SMILES

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

InChI

InChI=1S/C25H20BrN3O4S/c1-31-22-13-19-20(14-23(22)32-2)27-11-10-21(19)33-18-8-6-17(7-9-18)28-25(34)29-24(30)15-4-3-5-16(26)12-15/h3-14H,1-2H3,(H2,28,29,30,34)