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

Systemtic Name: 2-[4-(5-bromanyl-3-methyl-pyridin-2-yl)butylamino]-5-[1-(2-oxidanylidene-1H-pyridin-4-yl)ethyl]-1H-pyrimidin-6-one Openeye Name: 2-[4-(5-bromo-3-methyl-2-pyridyl)butylamino]-5-[1-(2-oxo-1H-pyridin-4-yl)ethyl]-1H-pyrimidin-6-one CAS Name: 2-[4-(5-bromo-3-methyl-2-pyridinyl)butylamino]-5-[1-(2-oxo-1H-pyridin-4-yl)ethyl]-1H-pyrimidin-6-one IUPAC Name: 2-[4-(5-bromo-3-methylpyridin-2-yl)butylamino]-5-[1-(2-oxo-1H-pyridin-4-yl)ethyl]-1H-pyrimidin-6-one Traditional Name: 2-[4-(5-bromo-3-methyl-2-pyridyl)butylamino]-5-[1-(2-keto-1H-pyridin-4-yl)ethyl]-1H-pyrimidin-6-one Formula: C21H24BrN5O2 MolecularWeight: 458.35156

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24BrN5O2/c1-13-9-16(22)11-25-18(13)5-3-4-7-24-21-26-12-17(20(29)27-21)14(2)15-6-8-23-19(28)10-15/h6,8-12,14H,3-5,7H2,1-2H3,(H,23,28)(H2,24,26,27,29)