[2-(4-chlorophenyl)-2-oxidanylidene-ethyl] 4-methylpiperazin-4-ium-1-carbodithioate

Systemtic Name: [2-(4-chlorophenyl)-2-oxidanylidene-ethyl] 4-methylpiperazin-4-ium-1-carbodithioate Openeye Name: [2-(4-chlorophenyl)-2-oxo-ethyl] 4-methylpiperazin-4-ium-1-carbodithioate CAS Name: 4-methyl-1-piperazin-4-iumcarbodithioic acid [2-(4-chlorophenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-chlorophenyl)-2-oxoethyl] 4-methylpiperazin-4-ium-1-carbodithioate Traditional Name: 4-methylpiperazin-4-ium-1-carbodithioic acid [2-(4-chlorophenyl)-2-keto-ethyl] ester Formula: C14H18ClN2OS2+ MolecularWeight: 329.88852

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(=S)SCC(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

C[NH+]1CCN(CC1)C(=S)SCC(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C14H17ClN2OS2/c1-16-6-8-17(9-7-16)14(19)20-10-13(18)11-2-4-12(15)5-3-11/h2-5H,6-10H2,1H3/p+1