1-[4-methyl-1-(phenylsulfonyl)pentyl]-3-phenylsulfanyl-piperidine hydrochloride

Systemtic Name: 1-[4-methyl-1-(phenylsulfonyl)pentyl]-3-phenylsulfanyl-piperidine hydrochloride Openeye Name: 1-[1-(benzenesulfonyl)-4-methyl-pentyl]-3-phenylsulfanyl-piperidine hydrochloride CAS Name: 1-[1-(benzenesulfonyl)-4-methylpentyl]-3-(phenylthio)piperidine hydrochloride IUPAC Name: 1-[1-(benzenesulfonyl)-4-methylpentyl]-3-phenylsulfanylpiperidine hydrochloride Traditional Name: 1-(1-besyl-4-methyl-pentyl)-3-(phenylthio)piperidine hydrochloride Formula: C23H32ClNO2S2 MolecularWeight: 454.08868

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(N1CCCC(C1)SC2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3.Cl

Isomeric SMILES

CC(C)CCC(N1CCCC(C1)SC2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3.Cl

InChI

InChI=1S/C23H31NO2S2.ClH/c1-19(2)15-16-23(28(25,26)22-13-7-4-8-14-22)24-17-9-12-21(18-24)27-20-10-5-3-6-11-20;/h3-8,10-11,13-14,19,21,23H,9,12,15-18H2,1-2H3;1H