3-nitro-N'-[(6-oxidanylidene-2-sulfanylidene-pyrimidin-5-ylidene)methyl]benzohydrazide

Systemtic Name: 3-nitro-N'-[(6-oxidanylidene-2-sulfanylidene-pyrimidin-5-ylidene)methyl]benzohydrazide Openeye Name: 3-nitro-N'-[(6-oxo-2-thioxo-pyrimidin-5-ylidene)methyl]benzohydrazide CAS Name: 3-nitro-N'-[(6-oxo-2-sulfanylidene-5-pyrimidinylidene)methyl]benzohydrazide IUPAC Name: 3-nitro-N'-[(6-oxo-2-sulfanylidenepyrimidin-5-ylidene)methyl]benzohydrazide Traditional Name: N'-[(6-keto-2-thioxo-pyrimidin-5-ylidene)methyl]-3-nitro-benzohydrazide Formula: C12H9N5O4S MolecularWeight: 319.29596

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H9N5O4S/c18-10-8(5-13-12(22)15-10)6-14-16-11(19)7-2-1-3-9(4-7)17(20)21/h1-6,14H,(H,16,19)(H,15,18,22)