3-[(4-nitropyrazol-1-yl)methyl]-N-(pyridin-4-ylmethyl)-1,2,4-oxadiazole-5-carboxamide

Systemtic Name: 3-[(4-nitropyrazol-1-yl)methyl]-N-(pyridin-4-ylmethyl)-1,2,4-oxadiazole-5-carboxamide Openeye Name: 3-[(4-nitropyrazol-1-yl)methyl]-N-(4-pyridylmethyl)-1,2,4-oxadiazole-5-carboxamide CAS Name: 3-[(4-nitro-1-pyrazolyl)methyl]-N-(pyridin-4-ylmethyl)-1,2,4-oxadiazole-5-carboxamide IUPAC Name: 3-[(4-nitropyrazol-1-yl)methyl]-N-(pyridin-4-ylmethyl)-1,2,4-oxadiazole-5-carboxamide Traditional Name: 3-[(4-nitropyrazol-1-yl)methyl]-N-(4-pyridylmethyl)-1,2,4-oxadiazole-5-carboxamide Formula: C13H11N7O4 MolecularWeight: 329.27094

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=CC=C1CNC(=O)C2=NC(=NO2)CN3C=C(C=N3)[N+](=O)[O-]

Isomeric SMILES

C1=CN=CC=C1CNC(=O)C2=NC(=NO2)CN3C=C(C=N3)[N+](=O)[O-]

InChI

InChI=1S/C13H11N7O4/c21-12(15-5-9-1-3-14-4-2-9)13-17-11(18-24-13)8-19-7-10(6-16-19)20(22)23/h1-4,6-7H,5,8H2,(H,15,21)