2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-[1-(phenylmethyl)pyrazol-3-yl]ethanamide

Systemtic Name: 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-[1-(phenylmethyl)pyrazol-3-yl]ethanamide Openeye Name: N-(1-benzylpyrazol-3-yl)-2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)acetamide CAS Name: 2-(3,5-dimethyl-4-nitro-1-pyrazolyl)-N-[1-(phenylmethyl)-3-pyrazolyl]acetamide IUPAC Name: N-(1-benzylpyrazol-3-yl)-2-(3,5-dimethyl-4-nitropyrazol-1-yl)acetamide Traditional Name: N-(1-benzylpyrazol-3-yl)-2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)acetamide Formula: C17H18N6O3 MolecularWeight: 354.36322

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(=O)NC2=NN(C=C2)CC3=CC=CC=C3)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC(=O)NC2=NN(C=C2)CC3=CC=CC=C3)C)[N+](=O)[O-]

InChI

InChI=1S/C17H18N6O3/c1-12-17(23(25)26)13(2)22(19-12)11-16(24)18-15-8-9-21(20-15)10-14-6-4-3-5-7-14/h3-9H,10-11H2,1-2H3,(H,18,20,24)