2-[2-(4-bromophenyl)carbonyl-2,5-diazabicyclo[2.2.1]heptan-5-yl]-3-methyl-6-pyridin-4-yl-pyrimidin-4-one

Systemtic Name: 2-[2-(4-bromophenyl)carbonyl-2,5-diazabicyclo[2.2.1]heptan-5-yl]-3-methyl-6-pyridin-4-yl-pyrimidin-4-one Openeye Name: 2-[2-(4-bromobenzoyl)-2,5-diazabicyclo[2.2.1]heptan-5-yl]-3-methyl-6-(4-pyridyl)pyrimidin-4-one CAS Name: 2-[2-[(4-bromophenyl)-oxomethyl]-2,5-diazabicyclo[2.2.1]heptan-5-yl]-3-methyl-6-pyridin-4-yl-4-pyrimidinone IUPAC Name: 2-[2-(4-bromobenzoyl)-2,5-diazabicyclo[2.2.1]heptan-5-yl]-3-methyl-6-pyridin-4-ylpyrimidin-4-one Traditional Name: 2-[2-(4-bromobenzoyl)-2,5-diazabicyclo[2.2.1]heptan-5-yl]-3-methyl-6-(4-pyridyl)pyrimidin-4-one Formula: C22H20BrN5O2 MolecularWeight: 466.3305

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C=C(N=C1N2CC3CC2CN3C(=O)C4=CC=C(C=C4)Br)C5=CC=NC=C5

Isomeric SMILES

CN1C(=O)C=C(N=C1N2CC3CC2CN3C(=O)C4=CC=C(C=C4)Br)C5=CC=NC=C5

InChI

InChI=1S/C22H20BrN5O2/c1-26-20(29)11-19(14-6-8-24-9-7-14)25-22(26)28-13-17-10-18(28)12-27(17)21(30)15-2-4-16(23)5-3-15/h2-9,11,17-18H,10,12-13H2,1H3