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

Systemtic Name: N-[[1-ethyl-5-[[(2-methylquinolin-4-yl)amino]methyl]piperidin-2-yl]methyl]naphthalene-1-sulfonamide Openeye Name: N-[[1-ethyl-5-[[(2-methyl-4-quinolyl)amino]methyl]-2-piperidyl]methyl]naphthalene-1-sulfonamide CAS Name: N-[[1-ethyl-5-[[(2-methyl-4-quinolinyl)amino]methyl]-2-piperidinyl]methyl]-1-naphthalenesulfonamide IUPAC Name: N-[[1-ethyl-5-[[(2-methylquinolin-4-yl)amino]methyl]piperidin-2-yl]methyl]naphthalene-1-sulfonamide Traditional Name: N-[[1-ethyl-5-[[(2-methyl-4-quinolyl)amino]methyl]-2-piperidyl]methyl]naphthalene-1-sulfonamide Formula: C29H34N4O2S MolecularWeight: 502.67086

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CC(CCC1CNS(=O)(=O)C2=CC=CC3=CC=CC=C32)CNC4=CC(=NC5=CC=CC=C54)C

Isomeric SMILES

CCN1CC(CCC1CNS(=O)(=O)C2=CC=CC3=CC=CC=C32)CNC4=CC(=NC5=CC=CC=C54)C

InChI

InChI=1S/C29H34N4O2S/c1-3-33-20-22(18-30-28-17-21(2)32-27-13-7-6-12-26(27)28)15-16-24(33)19-31-36(34,35)29-14-8-10-23-9-4-5-11-25(23)29/h4-14,17,22,24,31H,3,15-16,18-20H2,1-2H3,(H,30,32)