1-ethyl-4-[3-(5-methyl-4-nitro-pyrazol-1-yl)propanoylamino]pyrazole-3-carboxamide

Systemtic Name: 1-ethyl-4-[3-(5-methyl-4-nitro-pyrazol-1-yl)propanoylamino]pyrazole-3-carboxamide Openeye Name: 1-ethyl-4-[3-(5-methyl-4-nitro-pyrazol-1-yl)propanoylamino]pyrazole-3-carboxamide CAS Name: 1-ethyl-4-[[3-(5-methyl-4-nitro-1-pyrazolyl)-1-oxopropyl]amino]-3-pyrazolecarboxamide IUPAC Name: 1-ethyl-4-[3-(5-methyl-4-nitropyrazol-1-yl)propanoylamino]pyrazole-3-carboxamide Traditional Name: 1-ethyl-4-[3-(5-methyl-4-nitro-pyrazol-1-yl)propanoylamino]pyrazole-3-carboxamide Formula: C13H17N7O4 MolecularWeight: 335.31858

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C(=O)N)NC(=O)CCN2C(=C(C=N2)[N+](=O)[O-])C

Isomeric SMILES

CCN1C=C(C(=N1)C(=O)N)NC(=O)CCN2C(=C(C=N2)[N+](=O)[O-])C

InChI

InChI=1S/C13H17N7O4/c1-3-18-7-9(12(17-18)13(14)22)16-11(21)4-5-19-8(2)10(6-15-19)20(23)24/h6-7H,3-5H2,1-2H3,(H2,14,22)(H,16,21)