2-fluoranyl-N-[4-[4-[(1-pyrimidin-2-ylpiperidin-3-yl)methylamino]piperidin-1-yl]phenyl]benzamide

Systemtic Name: 2-fluoranyl-N-[4-[4-[(1-pyrimidin-2-ylpiperidin-3-yl)methylamino]piperidin-1-yl]phenyl]benzamide Openeye Name: 2-fluoro-N-[4-[4-[(1-pyrimidin-2-yl-3-piperidyl)methylamino]-1-piperidyl]phenyl]benzamide CAS Name: 2-fluoro-N-[4-[4-[[1-(2-pyrimidinyl)-3-piperidinyl]methylamino]-1-piperidinyl]phenyl]benzamide IUPAC Name: 2-fluoro-N-[4-[4-[(1-pyrimidin-2-ylpiperidin-3-yl)methylamino]piperidin-1-yl]phenyl]benzamide Traditional Name: 2-fluoro-N-[4-[4-[[1-(2-pyrimidyl)-3-piperidyl]methylamino]piperidino]phenyl]benzamide Formula: C28H33FN6O MolecularWeight: 488.599623

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=NC=CC=N2)CNC3CCN(CC3)C4=CC=C(C=C4)NC(=O)C5=CC=CC=C5F

Isomeric SMILES

C1CC(CN(C1)C2=NC=CC=N2)CNC3CCN(CC3)C4=CC=C(C=C4)NC(=O)C5=CC=CC=C5F

InChI

InChI=1S/C28H33FN6O/c29-26-7-2-1-6-25(26)27(36)33-23-8-10-24(11-9-23)34-17-12-22(13-18-34)32-19-21-5-3-16-35(20-21)28-30-14-4-15-31-28/h1-2,4,6-11,14-15,21-22,32H,3,5,12-13,16-20H2,(H,33,36)