2-[4-(diphenylmethyl)piperazin-1-yl]-6-(4-fluorophenyl)-1H-pyrimidin-4-one

Systemtic Name: 2-[4-(diphenylmethyl)piperazin-1-yl]-6-(4-fluorophenyl)-1H-pyrimidin-4-one Openeye Name: 2-(4-benzhydrylpiperazin-1-yl)-6-(4-fluorophenyl)-1H-pyrimidin-4-one CAS Name: 2-[4-(diphenylmethyl)-1-piperazinyl]-6-(4-fluorophenyl)-1H-pyrimidin-4-one IUPAC Name: 2-(4-benzhydrylpiperazin-1-yl)-6-(4-fluorophenyl)-1H-pyrimidin-4-one Traditional Name: 2-(4-benzhydrylpiperazino)-6-(4-fluorophenyl)-1H-pyrimidin-4-one Formula: C27H25FN4O MolecularWeight: 440.512003

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC(=O)C=C(N2)C3=CC=C(C=C3)F)C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1C2=NC(=O)C=C(N2)C3=CC=C(C=C3)F)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C27H25FN4O/c28-23-13-11-20(12-14-23)24-19-25(33)30-27(29-24)32-17-15-31(16-18-32)26(21-7-3-1-4-8-21)22-9-5-2-6-10-22/h1-14,19,26H,15-18H2,(H,29,30,33)