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

Systemtic Name: 4-cyclohexyl-N-[[4-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]carbamothioyl]benzamide Openeye Name: 4-cyclohexyl-N-[[4-[(6,7-dimethoxy-4-quinolyl)oxy]phenyl]carbamothioyl]benzamide CAS Name: 4-cyclohexyl-N-[[4-[(6,7-dimethoxy-4-quinolinyl)oxy]anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 4-cyclohexyl-N-[[4-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]carbamothioyl]benzamide Traditional Name: 4-cyclohexyl-N-[[4-[(6,7-dimethoxy-4-quinolyl)oxy]phenyl]thiocarbamoyl]benzamide Formula: C31H31N3O4S MolecularWeight: 541.66054

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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=C(C=C4)C5CCCCC5

Isomeric SMILES

COC1=CC2=C(C=CN=C2C=C1OC)OC3=CC=C(C=C3)NC(=S)NC(=O)C4=CC=C(C=C4)C5CCCCC5

InChI

InChI=1S/C31H31N3O4S/c1-36-28-18-25-26(19-29(28)37-2)32-17-16-27(25)38-24-14-12-23(13-15-24)33-31(39)34-30(35)22-10-8-21(9-11-22)20-6-4-3-5-7-20/h8-20H,3-7H2,1-2H3,(H2,33,34,35,39)