2,4-dinitro-N'-[(6-oxidanylidene-2-sulfanylidene-pyrimidin-5-ylidene)methyl]benzohydrazide

Systemtic Name: 2,4-dinitro-N'-[(6-oxidanylidene-2-sulfanylidene-pyrimidin-5-ylidene)methyl]benzohydrazide Openeye Name: 2,4-dinitro-N'-[(6-oxo-2-thioxo-pyrimidin-5-ylidene)methyl]benzohydrazide CAS Name: 2,4-dinitro-N'-[(6-oxo-2-sulfanylidene-5-pyrimidinylidene)methyl]benzohydrazide IUPAC Name: 2,4-dinitro-N'-[(6-oxo-2-sulfanylidenepyrimidin-5-ylidene)methyl]benzohydrazide Traditional Name: N'-[(6-keto-2-thioxo-pyrimidin-5-ylidene)methyl]-2,4-dinitro-benzohydrazide Formula: C12H8N6O6S MolecularWeight: 364.29352

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])C(=O)NNC=C2C=NC(=S)NC2=O

Isomeric SMILES

C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])C(=O)NNC=C2C=NC(=S)NC2=O

InChI

InChI=1S/C12H8N6O6S/c19-10-6(4-13-12(25)15-10)5-14-16-11(20)8-2-1-7(17(21)22)3-9(8)18(23)24/h1-5,14H,(H,16,20)(H,15,19,25)