N-[[4-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]carbamothioyl]pyrrolidine-1-carboxamide

Systemtic Name: N-[[4-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]carbamothioyl]pyrrolidine-1-carboxamide Openeye Name: N-[[4-[(6,7-dimethoxy-4-quinolyl)oxy]phenyl]carbamothioyl]pyrrolidine-1-carboxamide CAS Name: N-[[4-[(6,7-dimethoxy-4-quinolinyl)oxy]anilino]-sulfanylidenemethyl]-1-pyrrolidinecarboxamide IUPAC Name: N-[[4-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]carbamothioyl]pyrrolidine-1-carboxamide Traditional Name: N-[[4-[(6,7-dimethoxy-4-quinolyl)oxy]phenyl]thiocarbamoyl]pyrrolidine-1-carboxamide Formula: C23H24N4O4S MolecularWeight: 452.52606

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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)N4CCCC4

Isomeric SMILES

COC1=CC2=C(C=CN=C2C=C1OC)OC3=CC=C(C=C3)NC(=S)NC(=O)N4CCCC4

InChI

InChI=1S/C23H24N4O4S/c1-29-20-13-17-18(14-21(20)30-2)24-10-9-19(17)31-16-7-5-15(6-8-16)25-22(32)26-23(28)27-11-3-4-12-27/h5-10,13-14H,3-4,11-12H2,1-2H3,(H2,25,26,28,32)