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

Systemtic Name: 4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-(6-piperidin-1-ylpyridin-3-yl)benzamide Openeye Name: 4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-[6-(1-piperidyl)-3-pyridyl]benzamide CAS Name: 4-[(3,5-dimethyl-4-nitro-1-pyrazolyl)methyl]-N-[6-(1-piperidinyl)-3-pyridinyl]benzamide IUPAC Name: 4-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]-N-(6-piperidin-1-ylpyridin-3-yl)benzamide Traditional Name: 4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-(6-piperidino-3-pyridyl)benzamide Formula: C23H26N6O3 MolecularWeight: 434.49094

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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)N4CCCCC4)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=C(C=C2)C(=O)NC3=CN=C(C=C3)N4CCCCC4)C)[N+](=O)[O-]

InChI

InChI=1S/C23H26N6O3/c1-16-22(29(31)32)17(2)28(26-16)15-18-6-8-19(9-7-18)23(30)25-20-10-11-21(24-14-20)27-12-4-3-5-13-27/h6-11,14H,3-5,12-13,15H2,1-2H3,(H,25,30)