N,1-dimethyl-4-[2-(4-nitropyrazol-1-yl)butanoylamino]pyrazole-3-carboxamide

Systemtic Name: N,1-dimethyl-4-[2-(4-nitropyrazol-1-yl)butanoylamino]pyrazole-3-carboxamide Openeye Name: N,1-dimethyl-4-[2-(4-nitropyrazol-1-yl)butanoylamino]pyrazole-3-carboxamide CAS Name: N,1-dimethyl-4-[[2-(4-nitro-1-pyrazolyl)-1-oxobutyl]amino]-3-pyrazolecarboxamide IUPAC Name: N,1-dimethyl-4-[2-(4-nitropyrazol-1-yl)butanoylamino]pyrazole-3-carboxamide Traditional Name: N,1-dimethyl-4-[2-(4-nitropyrazol-1-yl)butanoylamino]pyrazole-3-carboxamide Formula: C13H17N7O4 MolecularWeight: 335.31858

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CN(N=C1C(=O)NC)C)N2C=C(C=N2)[N+](=O)[O-]

Isomeric SMILES

CCC(C(=O)NC1=CN(N=C1C(=O)NC)C)N2C=C(C=N2)[N+](=O)[O-]

InChI

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