N-[[5-chloranyl-6-(6,7-dimethoxyquinolin-4-yl)oxy-pyridin-3-yl]carbamothioyl]-2-phenyl-ethanamide

Systemtic Name: N-[[5-chloranyl-6-(6,7-dimethoxyquinolin-4-yl)oxy-pyridin-3-yl]carbamothioyl]-2-phenyl-ethanamide Openeye Name: N-[[5-chloro-6-[(6,7-dimethoxy-4-quinolyl)oxy]-3-pyridyl]carbamothioyl]-2-phenyl-acetamide CAS Name: N-[[[5-chloro-6-[(6,7-dimethoxy-4-quinolinyl)oxy]-3-pyridinyl]amino]-sulfanylidenemethyl]-2-phenylacetamide IUPAC Name: N-[[5-chloro-6-(6,7-dimethoxyquinolin-4-yl)oxypyridin-3-yl]carbamothioyl]-2-phenylacetamide Traditional Name: N-[[5-chloro-6-[(6,7-dimethoxy-4-quinolyl)oxy]-3-pyridyl]thiocarbamoyl]-2-phenyl-acetamide Formula: C25H21ClN4O4S MolecularWeight: 508.97664

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=CN=C2C=C1OC)OC3=C(C=C(C=N3)NC(=S)NC(=O)CC4=CC=CC=C4)Cl

Isomeric SMILES

COC1=CC2=C(C=CN=C2C=C1OC)OC3=C(C=C(C=N3)NC(=S)NC(=O)CC4=CC=CC=C4)Cl

InChI

InChI=1S/C25H21ClN4O4S/c1-32-21-12-17-19(13-22(21)33-2)27-9-8-20(17)34-24-18(26)11-16(14-28-24)29-25(35)30-23(31)10-15-6-4-3-5-7-15/h3-9,11-14H,10H2,1-2H3,(H2,29,30,31,35)