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

Systemtic Name: 1-ethyl-4-[3-(5-methyl-3-nitro-pyrazol-1-yl)propanoylamino]-N-(2-methylpropyl)pyrazole-3-carboxamide Openeye Name: 1-ethyl-N-isobutyl-4-[3-(5-methyl-3-nitro-pyrazol-1-yl)propanoylamino]pyrazole-3-carboxamide CAS Name: 1-ethyl-4-[[3-(5-methyl-3-nitro-1-pyrazolyl)-1-oxopropyl]amino]-N-(2-methylpropyl)-3-pyrazolecarboxamide IUPAC Name: 1-ethyl-4-[3-(5-methyl-3-nitropyrazol-1-yl)propanoylamino]-N-(2-methylpropyl)pyrazole-3-carboxamide Traditional Name: 1-ethyl-N-isobutyl-4-[3-(5-methyl-3-nitro-pyrazol-1-yl)propanoylamino]pyrazole-3-carboxamide Formula: C17H25N7O4 MolecularWeight: 391.4249

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H25N7O4/c1-5-22-10-13(16(21-22)17(26)18-9-11(2)3)19-15(25)6-7-23-12(4)8-14(20-23)24(27)28/h8,10-11H,5-7,9H2,1-4H3,(H,18,26)(H,19,25)