3-methyl-6-pyrimidin-4-yl-2-[(1R)-5-quinolin-3-yl-2,5-diazabicyclo[2.2.1]heptan-2-yl]pyrimidin-4-one

Systemtic Name: 3-methyl-6-pyrimidin-4-yl-2-[(1R)-5-quinolin-3-yl-2,5-diazabicyclo[2.2.1]heptan-2-yl]pyrimidin-4-one Openeye Name: 3-methyl-6-pyrimidin-4-yl-2-[(1R)-5-(3-quinolyl)-2,5-diazabicyclo[2.2.1]heptan-2-yl]pyrimidin-4-one CAS Name: 3-methyl-6-(4-pyrimidinyl)-2-[(1R)-5-(3-quinolinyl)-2,5-diazabicyclo[2.2.1]heptan-2-yl]-4-pyrimidinone IUPAC Name: 3-methyl-6-pyrimidin-4-yl-2-[(1R)-5-quinolin-3-yl-2,5-diazabicyclo[2.2.1]heptan-2-yl]pyrimidin-4-one Traditional Name: 3-methyl-6-(4-pyrimidyl)-2-[(1R)-5-(3-quinolyl)-2,5-diazabicyclo[2.2.1]heptan-2-yl]pyrimidin-4-one Formula: C23H21N7O MolecularWeight: 411.45914

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C=C(N=C1N2CC3CC2CN3C4=CC5=CC=CC=C5N=C4)C6=NC=NC=C6

Isomeric SMILES

CN1C(=O)C=C(N=C1N2CC3C[C@@H]2CN3C4=CC5=CC=CC=C5N=C4)C6=NC=NC=C6

InChI

InChI=1S/C23H21N7O/c1-28-22(31)10-21(20-6-7-24-14-26-20)27-23(28)30-13-17-9-18(30)12-29(17)16-8-15-4-2-3-5-19(15)25-11-16/h2-8,10-11,14,17-18H,9,12-13H2,1H3/t17?,18-/m1/s1