N-[(6,7-dimethoxyquinolin-4-yl)oxy-phenyl-carbamothioyl]-5-phenyl-pentanamide

Systemtic Name: N-[(6,7-dimethoxyquinolin-4-yl)oxy-phenyl-carbamothioyl]-5-phenyl-pentanamide Openeye Name: N-[(6,7-dimethoxy-4-quinolyl)oxy-phenyl-carbamothioyl]-5-phenyl-pentanamide CAS Name: N-[[N-[(6,7-dimethoxy-4-quinolinyl)oxy]anilino]-sulfanylidenemethyl]-5-phenylpentanamide IUPAC Name: N-[(6,7-dimethoxyquinolin-4-yl)oxy-phenylcarbamothioyl]-5-phenylpentanamide Traditional Name: N-[(6,7-dimethoxy-4-quinolyl)oxy-phenyl-thiocarbamoyl]-5-phenyl-valeramide Formula: C29H29N3O4S MolecularWeight: 515.62326

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=CN=C2C=C1OC)ON(C3=CC=CC=C3)C(=S)NC(=O)CCCCC4=CC=CC=C4

Isomeric SMILES

COC1=CC2=C(C=CN=C2C=C1OC)ON(C3=CC=CC=C3)C(=S)NC(=O)CCCCC4=CC=CC=C4

InChI

InChI=1S/C29H29N3O4S/c1-34-26-19-23-24(20-27(26)35-2)30-18-17-25(23)36-32(22-14-7-4-8-15-22)29(37)31-28(33)16-10-9-13-21-11-5-3-6-12-21/h3-8,11-12,14-15,17-20H,9-10,13,16H2,1-2H3,(H,31,33,37)