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

Systemtic Name: 3-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-[1-(phenylmethyl)pyrazol-3-yl]benzamide Openeye Name: N-(1-benzylpyrazol-3-yl)-3-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]benzamide CAS Name: 3-[(3,5-dimethyl-4-nitro-1-pyrazolyl)methyl]-N-[1-(phenylmethyl)-3-pyrazolyl]benzamide IUPAC Name: N-(1-benzylpyrazol-3-yl)-3-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]benzamide Traditional Name: N-(1-benzylpyrazol-3-yl)-3-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]benzamide Formula: C23H22N6O3 MolecularWeight: 430.45918

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=CC(=C2)C(=O)NC3=NN(C=C3)CC4=CC=CC=C4)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=CC(=C2)C(=O)NC3=NN(C=C3)CC4=CC=CC=C4)C)[N+](=O)[O-]

InChI

InChI=1S/C23H22N6O3/c1-16-22(29(31)32)17(2)28(25-16)15-19-9-6-10-20(13-19)23(30)24-21-11-12-27(26-21)14-18-7-4-3-5-8-18/h3-13H,14-15H2,1-2H3,(H,24,26,30)