1-ethyl-4-[2-(5-methyl-3-nitro-pyrazol-1-yl)propanoylamino]pyrazole-3-carboxamide

Systemtic Name: 1-ethyl-4-[2-(5-methyl-3-nitro-pyrazol-1-yl)propanoylamino]pyrazole-3-carboxamide Openeye Name: 1-ethyl-4-[2-(5-methyl-3-nitro-pyrazol-1-yl)propanoylamino]pyrazole-3-carboxamide CAS Name: 1-ethyl-4-[[2-(5-methyl-3-nitro-1-pyrazolyl)-1-oxopropyl]amino]-3-pyrazolecarboxamide IUPAC Name: 1-ethyl-4-[2-(5-methyl-3-nitropyrazol-1-yl)propanoylamino]pyrazole-3-carboxamide Traditional Name: 1-ethyl-4-[2-(5-methyl-3-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)C(C)N2C(=CC(=N2)[N+](=O)[O-])C

Isomeric SMILES

CCN1C=C(C(=N1)C(=O)N)NC(=O)C(C)N2C(=CC(=N2)[N+](=O)[O-])C

InChI

InChI=1S/C13H17N7O4/c1-4-18-6-9(11(17-18)12(14)21)15-13(22)8(3)19-7(2)5-10(16-19)20(23)24/h5-6,8H,4H2,1-3H3,(H2,14,21)(H,15,22)