(3,3-dimethyl-2-oxidanylidene-butyl) 4-methylpiperazin-4-ium-1-carbodithioate

Systemtic Name: (3,3-dimethyl-2-oxidanylidene-butyl) 4-methylpiperazin-4-ium-1-carbodithioate Openeye Name: (3,3-dimethyl-2-oxo-butyl) 4-methylpiperazin-4-ium-1-carbodithioate CAS Name: 4-methyl-1-piperazin-4-iumcarbodithioic acid (3,3-dimethyl-2-oxobutyl) ester IUPAC Name: (3,3-dimethyl-2-oxobutyl) 4-methylpiperazin-4-ium-1-carbodithioate Traditional Name: 4-methylpiperazin-4-ium-1-carbodithioic acid (2-keto-3,3-dimethyl-butyl) ester Formula: C12H23N2OS2+ MolecularWeight: 275.45382

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)CSC(=S)N1CC[NH+](CC1)C

Isomeric SMILES

CC(C)(C)C(=O)CSC(=S)N1CC[NH+](CC1)C

InChI

InChI=1S/C12H22N2OS2/c1-12(2,3)10(15)9-17-11(16)14-7-5-13(4)6-8-14/h5-9H2,1-4H3/p+1