1-ethyl-N-(2-methylpropyl)-4-[3-(3-nitropyrazol-1-yl)propanoylamino]pyrazole-3-carboxamide

Systemtic Name: 1-ethyl-N-(2-methylpropyl)-4-[3-(3-nitropyrazol-1-yl)propanoylamino]pyrazole-3-carboxamide Openeye Name: 1-ethyl-N-isobutyl-4-[3-(3-nitropyrazol-1-yl)propanoylamino]pyrazole-3-carboxamide CAS Name: 1-ethyl-N-(2-methylpropyl)-4-[[3-(3-nitro-1-pyrazolyl)-1-oxopropyl]amino]-3-pyrazolecarboxamide IUPAC Name: 1-ethyl-N-(2-methylpropyl)-4-[3-(3-nitropyrazol-1-yl)propanoylamino]pyrazole-3-carboxamide Traditional Name: 1-ethyl-N-isobutyl-4-[3-(3-nitropyrazol-1-yl)propanoylamino]pyrazole-3-carboxamide Formula: C16H23N7O4 MolecularWeight: 377.39832

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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-]

Isomeric SMILES

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

InChI

InChI=1S/C16H23N7O4/c1-4-21-10-12(15(20-21)16(25)17-9-11(2)3)18-14(24)6-8-22-7-5-13(19-22)23(26)27/h5,7,10-11H,4,6,8-9H2,1-3H3,(H,17,25)(H,18,24)