N-[[2-chloranyl-4-(6,7-dimethoxyquinolin-4-yl)oxy-phenyl]carbamothioyl]-2-phenyl-ethanamide

Systemtic Name: N-[[2-chloranyl-4-(6,7-dimethoxyquinolin-4-yl)oxy-phenyl]carbamothioyl]-2-phenyl-ethanamide Openeye Name: N-[[2-chloro-4-[(6,7-dimethoxy-4-quinolyl)oxy]phenyl]carbamothioyl]-2-phenyl-acetamide CAS Name: N-[[2-chloro-4-[(6,7-dimethoxy-4-quinolinyl)oxy]anilino]-sulfanylidenemethyl]-2-phenylacetamide IUPAC Name: N-[[2-chloro-4-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]carbamothioyl]-2-phenylacetamide Traditional Name: N-[[2-chloro-4-[(6,7-dimethoxy-4-quinolyl)oxy]phenyl]thiocarbamoyl]-2-phenyl-acetamide Formula: C26H22ClN3O4S MolecularWeight: 507.98858

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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)CC4=CC=CC=C4)Cl

Isomeric SMILES

COC1=CC2=C(C=CN=C2C=C1OC)OC3=CC(=C(C=C3)NC(=S)NC(=O)CC4=CC=CC=C4)Cl

InChI

InChI=1S/C26H22ClN3O4S/c1-32-23-14-18-21(15-24(23)33-2)28-11-10-22(18)34-17-8-9-20(19(27)13-17)29-26(35)30-25(31)12-16-6-4-3-5-7-16/h3-11,13-15H,12H2,1-2H3,(H2,29,30,31,35)