N-[[4-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]carbamothioyl]-2-phenyl-cyclopropane-1-carboxamide

Systemtic Name: N-[[4-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]carbamothioyl]-2-phenyl-cyclopropane-1-carboxamide Openeye Name: N-[[4-[(6,7-dimethoxy-4-quinolyl)oxy]phenyl]carbamothioyl]-2-phenyl-cyclopropanecarboxamide CAS Name: N-[[4-[(6,7-dimethoxy-4-quinolinyl)oxy]anilino]-sulfanylidenemethyl]-2-phenyl-1-cyclopropanecarboxamide IUPAC Name: N-[[4-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]carbamothioyl]-2-phenylcyclopropane-1-carboxamide Traditional Name: N-[[4-[(6,7-dimethoxy-4-quinolyl)oxy]phenyl]thiocarbamoyl]-2-phenyl-cyclopropanecarboxamide Formula: C28H25N3O4S MolecularWeight: 499.5808

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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)C4CC4C5=CC=CC=C5

Isomeric SMILES

COC1=CC2=C(C=CN=C2C=C1OC)OC3=CC=C(C=C3)NC(=S)NC(=O)C4CC4C5=CC=CC=C5

InChI

InChI=1S/C28H25N3O4S/c1-33-25-15-22-23(16-26(25)34-2)29-13-12-24(22)35-19-10-8-18(9-11-19)30-28(36)31-27(32)21-14-20(21)17-6-4-3-5-7-17/h3-13,15-16,20-21H,14H2,1-2H3,(H2,30,31,32,36)