6-[[4-[4,4-bis(4-fluorophenyl)butyl]piperazin-1-yl]methyl]-2-cyclopropyl-1H-pyrimidin-4-one

Systemtic Name: 6-[[4-[4,4-bis(4-fluorophenyl)butyl]piperazin-1-yl]methyl]-2-cyclopropyl-1H-pyrimidin-4-one Openeye Name: 6-[[4-[4,4-bis(4-fluorophenyl)butyl]piperazin-1-yl]methyl]-2-cyclopropyl-1H-pyrimidin-4-one CAS Name: 6-[[4-[4,4-bis(4-fluorophenyl)butyl]-1-piperazinyl]methyl]-2-cyclopropyl-1H-pyrimidin-4-one IUPAC Name: 6-[[4-[4,4-bis(4-fluorophenyl)butyl]piperazin-1-yl]methyl]-2-cyclopropyl-1H-pyrimidin-4-one Traditional Name: 6-[[4-[4,4-bis(4-fluorophenyl)butyl]piperazino]methyl]-2-cyclopropyl-1H-pyrimidin-4-one Formula: C28H32F2N4O MolecularWeight: 478.576686

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NC(=O)C=C(N2)CN3CCN(CC3)CCCC(C4=CC=C(C=C4)F)C5=CC=C(C=C5)F

Isomeric SMILES

C1CC1C2=NC(=O)C=C(N2)CN3CCN(CC3)CCCC(C4=CC=C(C=C4)F)C5=CC=C(C=C5)F

InChI

InChI=1S/C28H32F2N4O/c29-23-9-5-20(6-10-23)26(21-7-11-24(30)12-8-21)2-1-13-33-14-16-34(17-15-33)19-25-18-27(35)32-28(31-25)22-3-4-22/h5-12,18,22,26H,1-4,13-17,19H2,(H,31,32,35)