N-[[1-ethyl-5-[[(2-methylquinolin-4-yl)amino]methyl]piperidin-2-yl]methyl]benzenesulfonamide

Systemtic Name: N-[[1-ethyl-5-[[(2-methylquinolin-4-yl)amino]methyl]piperidin-2-yl]methyl]benzenesulfonamide Openeye Name: N-[[1-ethyl-5-[[(2-methyl-4-quinolyl)amino]methyl]-2-piperidyl]methyl]benzenesulfonamide CAS Name: N-[[1-ethyl-5-[[(2-methyl-4-quinolinyl)amino]methyl]-2-piperidinyl]methyl]benzenesulfonamide IUPAC Name: N-[[1-ethyl-5-[[(2-methylquinolin-4-yl)amino]methyl]piperidin-2-yl]methyl]benzenesulfonamide Traditional Name: N-[[1-ethyl-5-[[(2-methyl-4-quinolyl)amino]methyl]-2-piperidyl]methyl]benzenesulfonamide Formula: C25H32N4O2S MolecularWeight: 452.61218

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CC(CCC1CNS(=O)(=O)C2=CC=CC=C2)CNC3=CC(=NC4=CC=CC=C43)C

Isomeric SMILES

CCN1CC(CCC1CNS(=O)(=O)C2=CC=CC=C2)CNC3=CC(=NC4=CC=CC=C43)C

InChI

InChI=1S/C25H32N4O2S/c1-3-29-18-20(16-26-25-15-19(2)28-24-12-8-7-11-23(24)25)13-14-21(29)17-27-32(30,31)22-9-5-4-6-10-22/h4-12,15,20-21,27H,3,13-14,16-18H2,1-2H3,(H,26,28)