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

Systemtic Name: 4-chloranyl-N-[[4-(6,7-dimethoxyquinolin-4-yl)oxy-2-fluoranyl-phenyl]carbamothioyl]butanamide Openeye Name: 4-chloro-N-[[4-[(6,7-dimethoxy-4-quinolyl)oxy]-2-fluoro-phenyl]carbamothioyl]butanamide CAS Name: 4-chloro-N-[[4-[(6,7-dimethoxy-4-quinolinyl)oxy]-2-fluoroanilino]-sulfanylidenemethyl]butanamide IUPAC Name: 4-chloro-N-[[4-(6,7-dimethoxyquinolin-4-yl)oxy-2-fluorophenyl]carbamothioyl]butanamide Traditional Name: 4-chloro-N-[[4-[(6,7-dimethoxy-4-quinolyl)oxy]-2-fluoro-phenyl]thiocarbamoyl]butyramide Formula: C22H21ClFN3O4S MolecularWeight: 477.936243

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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)CCCCl)F

Isomeric SMILES

COC1=CC2=C(C=CN=C2C=C1OC)OC3=CC(=C(C=C3)NC(=S)NC(=O)CCCCl)F

InChI

InChI=1S/C22H21ClFN3O4S/c1-29-19-11-14-17(12-20(19)30-2)25-9-7-18(14)31-13-5-6-16(15(24)10-13)26-22(32)27-21(28)4-3-8-23/h5-7,9-12H,3-4,8H2,1-2H3,(H2,26,27,28,32)