1-[2-[4-(2-methylsulfanylethyl)piperazin-4-ium-1-yl]-2-oxidanylidene-ethyl]pyrrolidin-2-one

Systemtic Name: 1-[2-[4-(2-methylsulfanylethyl)piperazin-4-ium-1-yl]-2-oxidanylidene-ethyl]pyrrolidin-2-one Openeye Name: 1-[2-[4-(2-methylsulfanylethyl)piperazin-4-ium-1-yl]-2-oxo-ethyl]pyrrolidin-2-one CAS Name: 1-[2-[4-[2-(methylthio)ethyl]-1-piperazin-4-iumyl]-2-oxoethyl]-2-pyrrolidinone IUPAC Name: 1-[2-[4-(2-methylsulfanylethyl)piperazin-4-ium-1-yl]-2-oxoethyl]pyrrolidin-2-one Traditional Name: 1-[2-keto-2-[4-[2-(methylthio)ethyl]piperazin-4-ium-1-yl]ethyl]-2-pyrrolidone Formula: C13H24N3O2S+ MolecularWeight: 286.41356

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Descriptors Computed from Structure

Canonical SMILES:

CSCC[NH+]1CCN(CC1)C(=O)CN2CCCC2=O

Isomeric SMILES

CSCC[NH+]1CCN(CC1)C(=O)CN2CCCC2=O

InChI

InChI=1S/C13H23N3O2S/c1-19-10-9-14-5-7-15(8-6-14)13(18)11-16-4-2-3-12(16)17/h2-11H2,1H3/p+1