2-[3-[4-[bis(4-fluorophenyl)-oxidanyl-methyl]piperidin-1-yl]propylamino]-1H-pyrimidin-6-one

Systemtic Name: 2-[3-[4-[bis(4-fluorophenyl)-oxidanyl-methyl]piperidin-1-yl]propylamino]-1H-pyrimidin-6-one Openeye Name: 2-[3-[4-[bis(4-fluorophenyl)-hydroxy-methyl]-1-piperidyl]propylamino]-1H-pyrimidin-6-one CAS Name: 2-[3-[4-[bis(4-fluorophenyl)-hydroxymethyl]-1-piperidinyl]propylamino]-1H-pyrimidin-6-one IUPAC Name: 2-[3-[4-[bis(4-fluorophenyl)-hydroxymethyl]piperidin-1-yl]propylamino]-1H-pyrimidin-6-one Traditional Name: 2-[3-[4-[bis(4-fluorophenyl)-hydroxy-methyl]piperidino]propylamino]-1H-pyrimidin-6-one Formula: C25H28F2N4O2 MolecularWeight: 454.512226

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(C2=CC=C(C=C2)F)(C3=CC=C(C=C3)F)O)CCCNC4=NC=CC(=O)N4

Isomeric SMILES

C1CN(CCC1C(C2=CC=C(C=C2)F)(C3=CC=C(C=C3)F)O)CCCNC4=NC=CC(=O)N4

InChI

InChI=1S/C25H28F2N4O2/c26-21-6-2-18(3-7-21)25(33,19-4-8-22(27)9-5-19)20-11-16-31(17-12-20)15-1-13-28-24-29-14-10-23(32)30-24/h2-10,14,20,33H,1,11-13,15-17H2,(H2,28,29,30,32)