2-[4-(5-bromanyl-3-methyl-pyridin-2-yl)butylamino]-5-[(5,6-dimethylpyridin-3-yl)methyl]-1H-pyrimidin-6-one

Systemtic Name: 2-[4-(5-bromanyl-3-methyl-pyridin-2-yl)butylamino]-5-[(5,6-dimethylpyridin-3-yl)methyl]-1H-pyrimidin-6-one Openeye Name: 2-[4-(5-bromo-3-methyl-2-pyridyl)butylamino]-5-[(5,6-dimethyl-3-pyridyl)methyl]-1H-pyrimidin-6-one CAS Name: 2-[4-(5-bromo-3-methyl-2-pyridinyl)butylamino]-5-[(5,6-dimethyl-3-pyridinyl)methyl]-1H-pyrimidin-6-one IUPAC Name: 2-[4-(5-bromo-3-methylpyridin-2-yl)butylamino]-5-[(5,6-dimethylpyridin-3-yl)methyl]-1H-pyrimidin-6-one Traditional Name: 2-[4-(5-bromo-3-methyl-2-pyridyl)butylamino]-5-[(5,6-dimethyl-3-pyridyl)methyl]-1H-pyrimidin-6-one Formula: C22H26BrN5O MolecularWeight: 456.37874

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CN=C1CCCCNC2=NC=C(C(=O)N2)CC3=CC(=C(N=C3)C)C)Br

Isomeric SMILES

CC1=CC(=CN=C1CCCCNC2=NC=C(C(=O)N2)CC3=CC(=C(N=C3)C)C)Br

InChI

InChI=1S/C22H26BrN5O/c1-14-8-17(11-25-16(14)3)10-18-12-27-22(28-21(18)29)24-7-5-4-6-20-15(2)9-19(23)13-26-20/h8-9,11-13H,4-7,10H2,1-3H3,(H2,24,27,28,29)