[2-oxidanylidene-2-(3-phenyl-3,4-dihydropyrazol-2-yl)ethyl] 4-methylpiperazine-1-carbodithioate

Systemtic Name: [2-oxidanylidene-2-(3-phenyl-3,4-dihydropyrazol-2-yl)ethyl] 4-methylpiperazine-1-carbodithioate Openeye Name: [2-oxo-2-(3-phenyl-3,4-dihydropyrazol-2-yl)ethyl] 4-methylpiperazine-1-carbodithioate CAS Name: 4-methyl-1-piperazinecarbodithioic acid [2-oxo-2-(3-phenyl-3,4-dihydropyrazol-2-yl)ethyl] ester IUPAC Name: [2-oxo-2-(3-phenyl-3,4-dihydropyrazol-2-yl)ethyl] 4-methylpiperazine-1-carbodithioate Traditional Name: 4-methylpiperazine-1-carbodithioic acid [2-keto-2-(5-phenyl-2-pyrazolin-1-yl)ethyl] ester Formula: C17H22N4OS2 MolecularWeight: 362.51278

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=S)SCC(=O)N2C(CC=N2)C3=CC=CC=C3

Isomeric SMILES

CN1CCN(CC1)C(=S)SCC(=O)N2C(CC=N2)C3=CC=CC=C3

InChI

InChI=1S/C17H22N4OS2/c1-19-9-11-20(12-10-19)17(23)24-13-16(22)21-15(7-8-18-21)14-5-3-2-4-6-14/h2-6,8,15H,7,9-13H2,1H3