1-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-(4-phenylphenyl)pyrazole-3-carboxamide

Systemtic Name: 1-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-(4-phenylphenyl)pyrazole-3-carboxamide Openeye Name: 1-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-(4-phenylphenyl)pyrazole-3-carboxamide CAS Name: 1-[(3,5-dimethyl-4-nitro-1-pyrazolyl)methyl]-N-(4-phenylphenyl)-3-pyrazolecarboxamide IUPAC Name: 1-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]-N-(4-phenylphenyl)pyrazole-3-carboxamide Traditional Name: 1-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-(4-phenylphenyl)pyrazole-3-carboxamide Formula: C22H20N6O3 MolecularWeight: 416.4326

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CN2C=CC(=N2)C(=O)NC3=CC=C(C=C3)C4=CC=CC=C4)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CN2C=CC(=N2)C(=O)NC3=CC=C(C=C3)C4=CC=CC=C4)C)[N+](=O)[O-]

InChI

InChI=1S/C22H20N6O3/c1-15-21(28(30)31)16(2)27(24-15)14-26-13-12-20(25-26)22(29)23-19-10-8-18(9-11-19)17-6-4-3-5-7-17/h3-13H,14H2,1-2H3,(H,23,29)