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

Systemtic Name: 3-methyl-2-[2-(3-methylphenyl)carbonyl-2,5-diazabicyclo[2.2.1]heptan-5-yl]-6-pyridin-4-yl-pyrimidin-4-one Openeye Name: 3-methyl-2-[2-(3-methylbenzoyl)-2,5-diazabicyclo[2.2.1]heptan-5-yl]-6-(4-pyridyl)pyrimidin-4-one CAS Name: 3-methyl-2-[2-[(3-methylphenyl)-oxomethyl]-2,5-diazabicyclo[2.2.1]heptan-5-yl]-6-pyridin-4-yl-4-pyrimidinone IUPAC Name: 3-methyl-2-[2-(3-methylbenzoyl)-2,5-diazabicyclo[2.2.1]heptan-5-yl]-6-pyridin-4-ylpyrimidin-4-one Traditional Name: 3-methyl-2-(2-m-toluoyl-2,5-diazabicyclo[2.2.1]heptan-5-yl)-6-(4-pyridyl)pyrimidin-4-one Formula: C23H23N5O2 MolecularWeight: 401.46102

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)N2CC3CC2CN3C4=NC(=CC(=O)N4C)C5=CC=NC=C5

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)N2CC3CC2CN3C4=NC(=CC(=O)N4C)C5=CC=NC=C5

InChI

InChI=1S/C23H23N5O2/c1-15-4-3-5-17(10-15)22(30)27-13-19-11-18(27)14-28(19)23-25-20(12-21(29)26(23)2)16-6-8-24-9-7-16/h3-10,12,18-19H,11,13-14H2,1-2H3