N-[3-[3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)propanoylamino]phenyl]-2-ethyl-pyrazole-3-carboxamide

Systemtic Name: N-[3-[3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)propanoylamino]phenyl]-2-ethyl-pyrazole-3-carboxamide Openeye Name: N-[3-[3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)propanoylamino]phenyl]-2-ethyl-pyrazole-3-carboxamide CAS Name: N-[3-[[3-(3,5-dimethyl-4-nitro-1-pyrazolyl)-1-oxopropyl]amino]phenyl]-2-ethyl-3-pyrazolecarboxamide IUPAC Name: N-[3-[3-(3,5-dimethyl-4-nitropyrazol-1-yl)propanoylamino]phenyl]-2-ethylpyrazole-3-carboxamide Traditional Name: N-[3-[3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)propanoylamino]phenyl]-2-ethyl-pyrazole-3-carboxamide Formula: C20H23N7O4 MolecularWeight: 425.44112

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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