(3-nitropyridin-2-yl) 4-(4-fluorophenyl)piperazine-1-carbodithioate

Systemtic Name: (3-nitropyridin-2-yl) 4-(4-fluorophenyl)piperazine-1-carbodithioate Openeye Name: (3-nitro-2-pyridyl) 4-(4-fluorophenyl)piperazine-1-carbodithioate CAS Name: 4-(4-fluorophenyl)-1-piperazinecarbodithioic acid (3-nitro-2-pyridinyl) ester IUPAC Name: (3-nitropyridin-2-yl) 4-(4-fluorophenyl)piperazine-1-carbodithioate Traditional Name: 4-(4-fluorophenyl)piperazine-1-carbodithioic acid (3-nitro-2-pyridyl) ester Formula: C16H15FN4O2S2 MolecularWeight: 378.444303

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15FN4O2S2/c17-12-3-5-13(6-4-12)19-8-10-20(11-9-19)16(24)25-15-14(21(22)23)2-1-7-18-15/h1-7H,8-11H2