4-[[4-[2-(4-pyrazol-1-ylphenyl)ethanoyl]piperazin-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 4-[[4-[2-(4-pyrazol-1-ylphenyl)ethanoyl]piperazin-1-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[4-[2-(4-pyrazol-1-ylphenyl)acetyl]piperazin-1-yl]methyl]benzonitrile CAS Name: 4-[[4-[1-oxo-2-[4-(1-pyrazolyl)phenyl]ethyl]-1-piperazinyl]methyl]benzonitrile IUPAC Name: 4-[[4-[2-(4-pyrazol-1-ylphenyl)acetyl]piperazin-1-yl]methyl]benzonitrile Traditional Name: 4-[[4-[2-(4-pyrazol-1-ylphenyl)acetyl]piperazino]methyl]benzonitrile Formula: C23H23N5O MolecularWeight: 385.46162

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(C=C2)C#N)C(=O)CC3=CC=C(C=C3)N4C=CC=N4

Isomeric SMILES

C1CN(CCN1CC2=CC=C(C=C2)C#N)C(=O)CC3=CC=C(C=C3)N4C=CC=N4

InChI

InChI=1S/C23H23N5O/c24-17-20-2-4-21(5-3-20)18-26-12-14-27(15-13-26)23(29)16-19-6-8-22(9-7-19)28-11-1-10-25-28/h1-11H,12-16,18H2