7-phenyl-4-[2-[4-(phenylmethyl)piperazin-1-yl]ethanoyl]-5H-pyrazolo[1,5-a]pyrimidine-3-carbonitrile

Systemtic Name: 7-phenyl-4-[2-[4-(phenylmethyl)piperazin-1-yl]ethanoyl]-5H-pyrazolo[1,5-a]pyrimidine-3-carbonitrile Openeye Name: 4-[2-(4-benzylpiperazin-1-yl)acetyl]-7-phenyl-5H-pyrazolo[1,5-a]pyrimidine-3-carbonitrile CAS Name: 4-[1-oxo-2-[4-(phenylmethyl)-1-piperazinyl]ethyl]-7-phenyl-5H-pyrazolo[1,5-a]pyrimidine-3-carbonitrile IUPAC Name: 4-[2-(4-benzylpiperazin-1-yl)acetyl]-7-phenyl-5H-pyrazolo[1,5-a]pyrimidine-3-carbonitrile Traditional Name: 4-[2-(4-benzylpiperazino)acetyl]-7-phenyl-5H-pyrazolo[1,5-a]pyrimidine-3-carbonitrile Formula: C26H26N6O MolecularWeight: 438.52424

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)CC(=O)N3CC=C(N4C3=C(C=N4)C#N)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)CC(=O)N3CC=C(N4C3=C(C=N4)C#N)C5=CC=CC=C5

InChI

InChI=1S/C26H26N6O/c27-17-23-18-28-32-24(22-9-5-2-6-10-22)11-12-31(26(23)32)25(33)20-30-15-13-29(14-16-30)19-21-7-3-1-4-8-21/h1-11,18H,12-16,19-20H2