N-(2-methylpropyl)-4-[3-oxidanylidene-3-[4-(phenylmethyl)piperidin-1-yl]propyl]benzenesulfonamide

Systemtic Name: N-(2-methylpropyl)-4-[3-oxidanylidene-3-[4-(phenylmethyl)piperidin-1-yl]propyl]benzenesulfonamide Openeye Name: 4-[3-(4-benzyl-1-piperidyl)-3-oxo-propyl]-N-isobutyl-benzenesulfonamide CAS Name: N-(2-methylpropyl)-4-[3-oxo-3-[4-(phenylmethyl)-1-piperidinyl]propyl]benzenesulfonamide IUPAC Name: 4-[3-(4-benzylpiperidin-1-yl)-3-oxopropyl]-N-(2-methylpropyl)benzenesulfonamide Traditional Name: 4-[3-(4-benzylpiperidino)-3-keto-propyl]-N-isobutyl-benzenesulfonamide Formula: C25H34N2O3S MolecularWeight: 442.61406

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNS(=O)(=O)C1=CC=C(C=C1)CCC(=O)N2CCC(CC2)CC3=CC=CC=C3

Isomeric SMILES

CC(C)CNS(=O)(=O)C1=CC=C(C=C1)CCC(=O)N2CCC(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C25H34N2O3S/c1-20(2)19-26-31(29,30)24-11-8-21(9-12-24)10-13-25(28)27-16-14-23(15-17-27)18-22-6-4-3-5-7-22/h3-9,11-12,20,23,26H,10,13-19H2,1-2H3