N-[2-(2,5-dimethylphenyl)-5-methyl-pyrazol-3-yl]-2-(4-ethanoylpiperazin-1-ium-1-yl)ethanamide

Systemtic Name: N-[2-(2,5-dimethylphenyl)-5-methyl-pyrazol-3-yl]-2-(4-ethanoylpiperazin-1-ium-1-yl)ethanamide Openeye Name: 2-(4-acetylpiperazin-1-ium-1-yl)-N-[2-(2,5-dimethylphenyl)-5-methyl-pyrazol-3-yl]acetamide CAS Name: 2-(4-acetyl-1-piperazin-1-iumyl)-N-[2-(2,5-dimethylphenyl)-5-methyl-3-pyrazolyl]acetamide IUPAC Name: 2-(4-acetylpiperazin-1-ium-1-yl)-N-[2-(2,5-dimethylphenyl)-5-methylpyrazol-3-yl]acetamide Traditional Name: 2-(4-acetylpiperazin-1-ium-1-yl)-N-[2-(2,5-dimethylphenyl)-5-methyl-pyrazol-3-yl]acetamide Formula: C20H28N5O2+ MolecularWeight: 370.46862

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2C(=CC(=N2)C)NC(=O)C[NH+]3CCN(CC3)C(=O)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2C(=CC(=N2)C)NC(=O)C[NH+]3CCN(CC3)C(=O)C

InChI

InChI=1S/C20H27N5O2/c1-14-5-6-15(2)18(11-14)25-19(12-16(3)22-25)21-20(27)13-23-7-9-24(10-8-23)17(4)26/h5-6,11-12H,7-10,13H2,1-4H3,(H,21,27)/p+1