2-(2-oxidanylidenepyrrolidin-1-yl)ethyl 4-methylpiperazin-4-ium-1-carbodithioate

Systemtic Name: 2-(2-oxidanylidenepyrrolidin-1-yl)ethyl 4-methylpiperazin-4-ium-1-carbodithioate Openeye Name: 2-(2-oxopyrrolidin-1-yl)ethyl 4-methylpiperazin-4-ium-1-carbodithioate CAS Name: 4-methyl-1-piperazin-4-iumcarbodithioic acid 2-(2-oxo-1-pyrrolidinyl)ethyl ester IUPAC Name: 2-(2-oxopyrrolidin-1-yl)ethyl 4-methylpiperazin-4-ium-1-carbodithioate Traditional Name: 4-methylpiperazin-4-ium-1-carbodithioic acid 2-(2-ketopyrrolidino)ethyl ester Formula: C12H22N3OS2+ MolecularWeight: 288.45258

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(=S)SCCN2CCCC2=O

Isomeric SMILES

C[NH+]1CCN(CC1)C(=S)SCCN2CCCC2=O

InChI

InChI=1S/C12H21N3OS2/c1-13-5-7-15(8-6-13)12(17)18-10-9-14-4-2-3-11(14)16/h2-10H2,1H3/p+1