[2-oxidanylidene-2-(4-phenoxyphenyl)ethyl] 4-methylpiperazine-1-carbodithioate

Systemtic Name: [2-oxidanylidene-2-(4-phenoxyphenyl)ethyl] 4-methylpiperazine-1-carbodithioate Openeye Name: [2-oxo-2-(4-phenoxyphenyl)ethyl] 4-methylpiperazine-1-carbodithioate CAS Name: 4-methyl-1-piperazinecarbodithioic acid [2-oxo-2-(4-phenoxyphenyl)ethyl] ester IUPAC Name: [2-oxo-2-(4-phenoxyphenyl)ethyl] 4-methylpiperazine-1-carbodithioate Traditional Name: 4-methylpiperazine-1-carbodithioic acid [2-keto-2-(4-phenoxyphenyl)ethyl] ester Formula: C20H22N2O2S2 MolecularWeight: 386.53088

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=S)SCC(=O)C2=CC=C(C=C2)OC3=CC=CC=C3

Isomeric SMILES

CN1CCN(CC1)C(=S)SCC(=O)C2=CC=C(C=C2)OC3=CC=CC=C3

InChI

InChI=1S/C20H22N2O2S2/c1-21-11-13-22(14-12-21)20(25)26-15-19(23)16-7-9-18(10-8-16)24-17-5-3-2-4-6-17/h2-10H,11-15H2,1H3