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

Systemtic Name: N-[(6,7-dimethoxyquinolin-4-yl)oxy-phenyl-carbamothioyl]pentanamide Openeye Name: N-[(6,7-dimethoxy-4-quinolyl)oxy-phenyl-carbamothioyl]pentanamide CAS Name: N-[[N-[(6,7-dimethoxy-4-quinolinyl)oxy]anilino]-sulfanylidenemethyl]pentanamide IUPAC Name: N-[(6,7-dimethoxyquinolin-4-yl)oxy-phenylcarbamothioyl]pentanamide Traditional Name: N-[(6,7-dimethoxy-4-quinolyl)oxy-phenyl-thiocarbamoyl]valeramide Formula: C23H25N3O4S MolecularWeight: 439.5273

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC(=S)N(C1=CC=CC=C1)OC2=C3C=C(C(=CC3=NC=C2)OC)OC

Isomeric SMILES

CCCCC(=O)NC(=S)N(C1=CC=CC=C1)OC2=C3C=C(C(=CC3=NC=C2)OC)OC

InChI

InChI=1S/C23H25N3O4S/c1-4-5-11-22(27)25-23(31)26(16-9-7-6-8-10-16)30-19-12-13-24-18-15-21(29-3)20(28-2)14-17(18)19/h6-10,12-15H,4-5,11H2,1-3H3,(H,25,27,31)