N-[5-(diethylsulfamoyl)-2-morpholin-4-yl-phenyl]-2-pyridin-2-yl-quinoline-4-carboxamide

Systemtic Name: N-[5-(diethylsulfamoyl)-2-morpholin-4-yl-phenyl]-2-pyridin-2-yl-quinoline-4-carboxamide Openeye Name: N-[5-(diethylsulfamoyl)-2-morpholino-phenyl]-2-(2-pyridyl)quinoline-4-carboxamide CAS Name: N-[5-(diethylsulfamoyl)-2-(4-morpholinyl)phenyl]-2-(2-pyridinyl)-4-quinolinecarboxamide IUPAC Name: N-[5-(diethylsulfamoyl)-2-morpholin-4-ylphenyl]-2-pyridin-2-ylquinoline-4-carboxamide Traditional Name: N-[5-(diethylsulfamoyl)-2-morpholino-phenyl]-2-(2-pyridyl)cinchoninamide Formula: C29H31N5O4S MolecularWeight: 545.65254

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)N2CCOCC2)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CC=N5

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)N2CCOCC2)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CC=N5

InChI

InChI=1S/C29H31N5O4S/c1-3-34(4-2)39(36,37)21-12-13-28(33-15-17-38-18-16-33)27(19-21)32-29(35)23-20-26(25-11-7-8-14-30-25)31-24-10-6-5-9-22(23)24/h5-14,19-20H,3-4,15-18H2,1-2H3,(H,32,35)