N-[3-(3,4-dihydro-2H-pyrrol-5-ylsulfamoyl)phenyl]-2-pyridin-2-yl-quinoline-4-carboxamide

Systemtic Name: N-[3-(3,4-dihydro-2H-pyrrol-5-ylsulfamoyl)phenyl]-2-pyridin-2-yl-quinoline-4-carboxamide Openeye Name: N-[3-(3,4-dihydro-2H-pyrrol-5-ylsulfamoyl)phenyl]-2-(2-pyridyl)quinoline-4-carboxamide CAS Name: N-[3-(3,4-dihydro-2H-pyrrol-5-ylsulfamoyl)phenyl]-2-(2-pyridinyl)-4-quinolinecarboxamide IUPAC Name: N-[3-(3,4-dihydro-2H-pyrrol-5-ylsulfamoyl)phenyl]-2-pyridin-2-ylquinoline-4-carboxamide Traditional Name: 2-(2-pyridyl)-N-[3-(1-pyrrolin-2-ylsulfamoyl)phenyl]cinchoninamide Formula: C25H21N5O3S MolecularWeight: 471.53094

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=NC1)NS(=O)(=O)C2=CC=CC(=C2)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CC=N5

Isomeric SMILES

C1CC(=NC1)NS(=O)(=O)C2=CC=CC(=C2)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CC=N5

InChI

InChI=1S/C25H21N5O3S/c31-25(28-17-7-5-8-18(15-17)34(32,33)30-24-12-6-14-27-24)20-16-23(22-11-3-4-13-26-22)29-21-10-2-1-9-19(20)21/h1-5,7-11,13,15-16H,6,12,14H2,(H,27,30)(H,28,31)