2-[2-(azepan-1-ylmethyl)phenyl]-6-(4-fluorophenyl)-1H-pyrimidin-4-one

Systemtic Name: 2-[2-(azepan-1-ylmethyl)phenyl]-6-(4-fluorophenyl)-1H-pyrimidin-4-one Openeye Name: 2-[2-(azepan-1-ylmethyl)phenyl]-6-(4-fluorophenyl)-1H-pyrimidin-4-one CAS Name: 2-[2-(1-azepanylmethyl)phenyl]-6-(4-fluorophenyl)-1H-pyrimidin-4-one IUPAC Name: 2-[2-(azepan-1-ylmethyl)phenyl]-6-(4-fluorophenyl)-1H-pyrimidin-4-one Traditional Name: 2-[2-(azepan-1-ylmethyl)phenyl]-6-(4-fluorophenyl)-1H-pyrimidin-4-one Formula: C23H24FN3O MolecularWeight: 377.454563

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CC2=CC=CC=C2C3=NC(=O)C=C(N3)C4=CC=C(C=C4)F

Isomeric SMILES

C1CCCN(CC1)CC2=CC=CC=C2C3=NC(=O)C=C(N3)C4=CC=C(C=C4)F

InChI

InChI=1S/C23H24FN3O/c24-19-11-9-17(10-12-19)21-15-22(28)26-23(25-21)20-8-4-3-7-18(20)16-27-13-5-1-2-6-14-27/h3-4,7-12,15H,1-2,5-6,13-14,16H2,(H,25,26,28)