2-[4-(3-methylsulfanylpropyl)piperazin-4-ium-1-yl]ethanol

Systemtic Name: 2-[4-(3-methylsulfanylpropyl)piperazin-4-ium-1-yl]ethanol Openeye Name: 2-[4-(3-methylsulfanylpropyl)piperazin-4-ium-1-yl]ethanol CAS Name: 2-[4-[3-(methylthio)propyl]-1-piperazin-4-iumyl]ethanol IUPAC Name: 2-[4-(3-methylsulfanylpropyl)piperazin-4-ium-1-yl]ethanol Traditional Name: 2-[4-[3-(methylthio)propyl]piperazin-4-ium-1-yl]ethanol Formula: C10H23N2OS+ MolecularWeight: 219.36742

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC[NH+]1CCN(CC1)CCO

Isomeric SMILES

CSCCC[NH+]1CCN(CC1)CCO

InChI

InChI=1S/C10H22N2OS/c1-14-10-2-3-11-4-6-12(7-5-11)8-9-13/h13H,2-10H2,1H3/p+1