[4-(phenylmethyl)piperazin-1-yl]-[4-(4-pyrimidin-4-ylpyrazol-1-yl)phenyl]methanone

Systemtic Name: [4-(phenylmethyl)piperazin-1-yl]-[4-(4-pyrimidin-4-ylpyrazol-1-yl)phenyl]methanone Openeye Name: (4-benzylpiperazin-1-yl)-[4-(4-pyrimidin-4-ylpyrazol-1-yl)phenyl]methanone CAS Name: [4-(phenylmethyl)-1-piperazinyl]-[4-[4-(4-pyrimidinyl)-1-pyrazolyl]phenyl]methanone IUPAC Name: (4-benzylpiperazin-1-yl)-[4-(4-pyrimidin-4-ylpyrazol-1-yl)phenyl]methanone Traditional Name: (4-benzylpiperazino)-[4-[4-(4-pyrimidyl)pyrazol-1-yl]phenyl]methanone Formula: C25H24N6O MolecularWeight: 424.49766

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C(=O)C3=CC=C(C=C3)N4C=C(C=N4)C5=NC=NC=C5

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C(=O)C3=CC=C(C=C3)N4C=C(C=N4)C5=NC=NC=C5

InChI

InChI=1S/C25H24N6O/c32-25(30-14-12-29(13-15-30)17-20-4-2-1-3-5-20)21-6-8-23(9-7-21)31-18-22(16-28-31)24-10-11-26-19-27-24/h1-11,16,18-19H,12-15,17H2