4-[[1-(2,5-dimethylphenyl)-3-phenyl-pyrazol-4-yl]methyl]piperazin-2-one

Systemtic Name: 4-[[1-(2,5-dimethylphenyl)-3-phenyl-pyrazol-4-yl]methyl]piperazin-2-one Openeye Name: 4-[[1-(2,5-dimethylphenyl)-3-phenyl-pyrazol-4-yl]methyl]piperazin-2-one CAS Name: 4-[[1-(2,5-dimethylphenyl)-3-phenyl-4-pyrazolyl]methyl]-2-piperazinone IUPAC Name: 4-[[1-(2,5-dimethylphenyl)-3-phenylpyrazol-4-yl]methyl]piperazin-2-one Traditional Name: 4-[[1-(2,5-dimethylphenyl)-3-phenyl-pyrazol-4-yl]methyl]piperazin-2-one Formula: C22H24N4O MolecularWeight: 360.45216

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2C=C(C(=N2)C3=CC=CC=C3)CN4CCNC(=O)C4

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2C=C(C(=N2)C3=CC=CC=C3)CN4CCNC(=O)C4

InChI

InChI=1S/C22H24N4O/c1-16-8-9-17(2)20(12-16)26-14-19(13-25-11-10-23-21(27)15-25)22(24-26)18-6-4-3-5-7-18/h3-9,12,14H,10-11,13,15H2,1-2H3,(H,23,27)