N-[3-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]-2-propan-2-yl-quinoline-4-carboxamide

Systemtic Name: N-[3-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]-2-propan-2-yl-quinoline-4-carboxamide Openeye Name: N-[3-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]-2-isopropyl-quinoline-4-carboxamide CAS Name: N-[3-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]-2-propan-2-yl-4-quinolinecarboxamide IUPAC Name: N-[3-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]-2-propan-2-ylquinoline-4-carboxamide Traditional Name: 2-isopropyl-N-[3-(1-pyrrolin-1-ium-2-ylsulfamoyl)phenyl]cinchoninamide Formula: C23H25N4O3S+ MolecularWeight: 437.5346

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC2=CC=CC=C2C(=C1)C(=O)NC3=CC(=CC=C3)S(=O)(=O)NC4=[NH+]CCC4

Isomeric SMILES

CC(C)C1=NC2=CC=CC=C2C(=C1)C(=O)NC3=CC(=CC=C3)S(=O)(=O)NC4=[NH+]CCC4

InChI

InChI=1S/C23H24N4O3S/c1-15(2)21-14-19(18-9-3-4-10-20(18)26-21)23(28)25-16-7-5-8-17(13-16)31(29,30)27-22-11-6-12-24-22/h3-5,7-10,13-15H,6,11-12H2,1-2H3,(H,24,27)(H,25,28)/p+1