4-[[4-(1-phenylpyrazol-4-yl)carbonylpiperazin-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 4-[[4-(1-phenylpyrazol-4-yl)carbonylpiperazin-1-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[4-(1-phenylpyrazole-4-carbonyl)piperazin-1-yl]methyl]benzonitrile CAS Name: 4-[[4-[oxo-(1-phenyl-4-pyrazolyl)methyl]-1-piperazinyl]methyl]benzonitrile IUPAC Name: 4-[[4-(1-phenylpyrazole-4-carbonyl)piperazin-1-yl]methyl]benzonitrile Traditional Name: 4-[[4-(1-phenylpyrazole-4-carbonyl)piperazino]methyl]benzonitrile Formula: C22H21N5O MolecularWeight: 371.43504

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(C=C2)C#N)C(=O)C3=CN(N=C3)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1CC2=CC=C(C=C2)C#N)C(=O)C3=CN(N=C3)C4=CC=CC=C4

InChI

InChI=1S/C22H21N5O/c23-14-18-6-8-19(9-7-18)16-25-10-12-26(13-11-25)22(28)20-15-24-27(17-20)21-4-2-1-3-5-21/h1-9,15,17H,10-13,16H2