N-(1,5-dimethylpyrazol-4-yl)-1-[(3-nitro-1,2,4-triazol-1-yl)methyl]pyrazole-3-carboxamide

Systemtic Name: N-(1,5-dimethylpyrazol-4-yl)-1-[(3-nitro-1,2,4-triazol-1-yl)methyl]pyrazole-3-carboxamide Openeye Name: N-(1,5-dimethylpyrazol-4-yl)-1-[(3-nitro-1,2,4-triazol-1-yl)methyl]pyrazole-3-carboxamide CAS Name: N-(1,5-dimethyl-4-pyrazolyl)-1-[(3-nitro-1,2,4-triazol-1-yl)methyl]-3-pyrazolecarboxamide IUPAC Name: N-(1,5-dimethylpyrazol-4-yl)-1-[(3-nitro-1,2,4-triazol-1-yl)methyl]pyrazole-3-carboxamide Traditional Name: N-(1,5-dimethylpyrazol-4-yl)-1-[(3-nitro-1,2,4-triazol-1-yl)methyl]pyrazole-3-carboxamide Formula: C12H13N9O3 MolecularWeight: 331.29012

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C)NC(=O)C2=NN(C=C2)CN3C=NC(=N3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=NN1C)NC(=O)C2=NN(C=C2)CN3C=NC(=N3)[N+](=O)[O-]

InChI

InChI=1S/C12H13N9O3/c1-8-10(5-14-18(8)2)15-11(22)9-3-4-19(16-9)7-20-6-13-12(17-20)21(23)24/h3-6H,7H2,1-2H3,(H,15,22)