2-[4-[2-(4-methylphenyl)sulfanylethyl]piperazin-4-ium-1-yl]ethanol

Systemtic Name: 2-[4-[2-(4-methylphenyl)sulfanylethyl]piperazin-4-ium-1-yl]ethanol Openeye Name: 2-[4-[2-(p-tolylsulfanyl)ethyl]piperazin-4-ium-1-yl]ethanol CAS Name: 2-[4-[2-[(4-methylphenyl)thio]ethyl]-1-piperazin-4-iumyl]ethanol IUPAC Name: 2-[4-[2-(4-methylphenyl)sulfanylethyl]piperazin-4-ium-1-yl]ethanol Traditional Name: 2-[4-[2-(p-tolylthio)ethyl]piperazin-4-ium-1-yl]ethanol Formula: C15H25N2OS+ MolecularWeight: 281.4368

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCC[NH+]2CCN(CC2)CCO

Isomeric SMILES

CC1=CC=C(C=C1)SCC[NH+]2CCN(CC2)CCO

InChI

InChI=1S/C15H24N2OS/c1-14-2-4-15(5-3-14)19-13-11-17-8-6-16(7-9-17)10-12-18/h2-5,18H,6-13H2,1H3/p+1