6-[1-(phenylcarbonyl)-4-(phenylmethyl)piperazin-2-yl]-2-pyridin-4-yl-1H-pyrimidin-4-one

Systemtic Name: 6-[1-(phenylcarbonyl)-4-(phenylmethyl)piperazin-2-yl]-2-pyridin-4-yl-1H-pyrimidin-4-one Openeye Name: 6-(1-benzoyl-4-benzyl-piperazin-2-yl)-2-(4-pyridyl)-1H-pyrimidin-4-one CAS Name: 6-[1-benzoyl-4-(phenylmethyl)-2-piperazinyl]-2-pyridin-4-yl-1H-pyrimidin-4-one IUPAC Name: 6-(1-benzoyl-4-benzylpiperazin-2-yl)-2-pyridin-4-yl-1H-pyrimidin-4-one Traditional Name: 6-(1-benzoyl-4-benzyl-piperazin-2-yl)-2-(4-pyridyl)-1H-pyrimidin-4-one Formula: C27H25N5O2 MolecularWeight: 451.5197

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(CN1CC2=CC=CC=C2)C3=CC(=O)N=C(N3)C4=CC=NC=C4)C(=O)C5=CC=CC=C5

Isomeric SMILES

C1CN(C(CN1CC2=CC=CC=C2)C3=CC(=O)N=C(N3)C4=CC=NC=C4)C(=O)C5=CC=CC=C5

InChI

InChI=1S/C27H25N5O2/c33-25-17-23(29-26(30-25)21-11-13-28-14-12-21)24-19-31(18-20-7-3-1-4-8-20)15-16-32(24)27(34)22-9-5-2-6-10-22/h1-14,17,24H,15-16,18-19H2,(H,29,30,33)