4-[3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)propanoylamino]-1-ethyl-N-phenyl-pyrazole-3-carboxamide

Systemtic Name: 4-[3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)propanoylamino]-1-ethyl-N-phenyl-pyrazole-3-carboxamide Openeye Name: 4-[3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)propanoylamino]-1-ethyl-N-phenyl-pyrazole-3-carboxamide CAS Name: 4-[[3-(3,5-dimethyl-4-nitro-1-pyrazolyl)-1-oxopropyl]amino]-1-ethyl-N-phenyl-3-pyrazolecarboxamide IUPAC Name: 4-[3-(3,5-dimethyl-4-nitropyrazol-1-yl)propanoylamino]-1-ethyl-N-phenylpyrazole-3-carboxamide Traditional Name: 4-[3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)propanoylamino]-1-ethyl-N-phenyl-pyrazole-3-carboxamide Formula: C20H23N7O4 MolecularWeight: 425.44112

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C(=O)NC2=CC=CC=C2)NC(=O)CCN3C(=C(C(=N3)C)[N+](=O)[O-])C

Isomeric SMILES

CCN1C=C(C(=N1)C(=O)NC2=CC=CC=C2)NC(=O)CCN3C(=C(C(=N3)C)[N+](=O)[O-])C

InChI

InChI=1S/C20H23N7O4/c1-4-25-12-16(18(24-25)20(29)21-15-8-6-5-7-9-15)22-17(28)10-11-26-14(3)19(27(30)31)13(2)23-26/h5-9,12H,4,10-11H2,1-3H3,(H,21,29)(H,22,28)