4-nitro-N'-(2-pyrimidin-2-ylsulfanylethanoyl)benzohydrazide

Systemtic Name: 4-nitro-N'-(2-pyrimidin-2-ylsulfanylethanoyl)benzohydrazide Openeye Name: 4-nitro-N'-(2-pyrimidin-2-ylsulfanylacetyl)benzohydrazide CAS Name: 4-nitro-N'-[1-oxo-2-(2-pyrimidinylthio)ethyl]benzohydrazide IUPAC Name: 4-nitro-N'-(2-pyrimidin-2-ylsulfanylacetyl)benzohydrazide Traditional Name: 4-nitro-N'-[2-(2-pyrimidylthio)acetyl]benzohydrazide Formula: C13H11N5O4S MolecularWeight: 333.32254

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(N=C1)SCC(=O)NNC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CN=C(N=C1)SCC(=O)NNC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H11N5O4S/c19-11(8-23-13-14-6-1-7-15-13)16-17-12(20)9-2-4-10(5-3-9)18(21)22/h1-7H,8H2,(H,16,19)(H,17,20)