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

Systemtic Name: 2-[4-(3-bromanylpyridin-2-yl)butylamino]-5-[(4-oxidanylidene-1H-pyridin-2-yl)methyl]-1H-pyrimidin-6-one Openeye Name: 2-[4-(3-bromo-2-pyridyl)butylamino]-5-[(4-oxo-1H-pyridin-2-yl)methyl]-1H-pyrimidin-6-one CAS Name: 2-[4-(3-bromo-2-pyridinyl)butylamino]-5-[(4-oxo-1H-pyridin-2-yl)methyl]-1H-pyrimidin-6-one IUPAC Name: 2-[4-(3-bromopyridin-2-yl)butylamino]-5-[(4-oxo-1H-pyridin-2-yl)methyl]-1H-pyrimidin-6-one Traditional Name: 2-[4-(3-bromo-2-pyridyl)butylamino]-5-[(4-keto-1H-pyridin-2-yl)methyl]-1H-pyrimidin-6-one Formula: C19H20BrN5O2 MolecularWeight: 430.2984

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(N=C1)CCCCNC2=NC=C(C(=O)N2)CC3=CC(=O)C=CN3)Br

Isomeric SMILES

C1=CC(=C(N=C1)CCCCNC2=NC=C(C(=O)N2)CC3=CC(=O)C=CN3)Br

InChI

InChI=1S/C19H20BrN5O2/c20-16-4-3-8-22-17(16)5-1-2-7-23-19-24-12-13(18(27)25-19)10-14-11-15(26)6-9-21-14/h3-4,6,8-9,11-12H,1-2,5,7,10H2,(H,21,26)(H2,23,24,25,27)