(4E)-4-[(4-methylpiperazin-1-yl)methylidene]-2,5-diphenyl-pyrazol-3-one

Systemtic Name: (4E)-4-[(4-methylpiperazin-1-yl)methylidene]-2,5-diphenyl-pyrazol-3-one Openeye Name: (4E)-4-[(4-methylpiperazin-1-yl)methylene]-2,5-diphenyl-pyrazol-3-one CAS Name: (4E)-4-[(4-methyl-1-piperazinyl)methylidene]-2,5-diphenyl-3-pyrazolone IUPAC Name: (4E)-4-[(4-methylpiperazin-1-yl)methylidene]-2,5-diphenylpyrazol-3-one Traditional Name: (4E)-4-[(4-methylpiperazino)methylene]-2,5-diphenyl-2-pyrazolin-3-one Formula: C21H22N4O MolecularWeight: 346.42558

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C=C2C(=NN(C2=O)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CN1CCN(CC1)/C=C/2\C(=NN(C2=O)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C21H22N4O/c1-23-12-14-24(15-13-23)16-19-20(17-8-4-2-5-9-17)22-25(21(19)26)18-10-6-3-7-11-18/h2-11,16H,12-15H2,1H3/b19-16+