N-[5-methyl-2-(4-methylphenyl)pyrazol-3-yl]-2-[4-(6-nitropyridin-3-yl)piperazin-1-yl]ethanamide

Systemtic Name: N-[5-methyl-2-(4-methylphenyl)pyrazol-3-yl]-2-[4-(6-nitropyridin-3-yl)piperazin-1-yl]ethanamide Openeye Name: N-[5-methyl-2-(p-tolyl)pyrazol-3-yl]-2-[4-(6-nitro-3-pyridyl)piperazin-1-yl]acetamide CAS Name: N-[5-methyl-2-(4-methylphenyl)-3-pyrazolyl]-2-[4-(6-nitro-3-pyridinyl)-1-piperazinyl]acetamide IUPAC Name: N-[5-methyl-2-(4-methylphenyl)pyrazol-3-yl]-2-[4-(6-nitropyridin-3-yl)piperazin-1-yl]acetamide Traditional Name: N-[5-methyl-2-(p-tolyl)pyrazol-3-yl]-2-[4-(6-nitro-3-pyridyl)piperazino]acetamide Formula: C22H25N7O3 MolecularWeight: 435.479

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=CC(=N2)C)NC(=O)CN3CCN(CC3)C4=CN=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=CC(=N2)C)NC(=O)CN3CCN(CC3)C4=CN=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H25N7O3/c1-16-3-5-18(6-4-16)28-21(13-17(2)25-28)24-22(30)15-26-9-11-27(12-10-26)19-7-8-20(23-14-19)29(31)32/h3-8,13-14H,9-12,15H2,1-2H3,(H,24,30)