4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-(6-imidazol-1-ylpyridin-3-yl)benzamide

Systemtic Name: 4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-(6-imidazol-1-ylpyridin-3-yl)benzamide Openeye Name: 4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-(6-imidazol-1-yl-3-pyridyl)benzamide CAS Name: 4-[(3,5-dimethyl-4-nitro-1-pyrazolyl)methyl]-N-[6-(1-imidazolyl)-3-pyridinyl]benzamide IUPAC Name: 4-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]-N-(6-imidazol-1-ylpyridin-3-yl)benzamide Traditional Name: 4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-(6-imidazol-1-yl-3-pyridyl)benzamide Formula: C21H19N7O3 MolecularWeight: 417.42066

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=C(C=C2)C(=O)NC3=CN=C(C=C3)N4C=CN=C4)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=C(C=C2)C(=O)NC3=CN=C(C=C3)N4C=CN=C4)C)[N+](=O)[O-]

InChI

InChI=1S/C21H19N7O3/c1-14-20(28(30)31)15(2)27(25-14)12-16-3-5-17(6-4-16)21(29)24-18-7-8-19(23-11-18)26-10-9-22-13-26/h3-11,13H,12H2,1-2H3,(H,24,29)