(3-nitropyridin-2-yl) 4-phenylpiperazine-1-carbodithioate

Systemtic Name: (3-nitropyridin-2-yl) 4-phenylpiperazine-1-carbodithioate Openeye Name: (3-nitro-2-pyridyl) 4-phenylpiperazine-1-carbodithioate CAS Name: 4-phenyl-1-piperazinecarbodithioic acid (3-nitro-2-pyridinyl) ester IUPAC Name: (3-nitropyridin-2-yl) 4-phenylpiperazine-1-carbodithioate Traditional Name: 4-phenylpiperazine-1-carbodithioic acid (3-nitro-2-pyridyl) ester Formula: C16H16N4O2S2 MolecularWeight: 360.45384

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C(=S)SC3=C(C=CC=N3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C(=S)SC3=C(C=CC=N3)[N+](=O)[O-]

InChI

InChI=1S/C16H16N4O2S2/c21-20(22)14-7-4-8-17-15(14)24-16(23)19-11-9-18(10-12-19)13-5-2-1-3-6-13/h1-8H,9-12H2