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

Systemtic Name: 2-[4-(5-bromanyl-3-methyl-pyridin-2-yl)butylamino]-5-[(5-methylpyridin-2-yl)methyl]-1H-pyrimidin-6-one Openeye Name: 2-[4-(5-bromo-3-methyl-2-pyridyl)butylamino]-5-[(5-methyl-2-pyridyl)methyl]-1H-pyrimidin-6-one CAS Name: 2-[4-(5-bromo-3-methyl-2-pyridinyl)butylamino]-5-[(5-methyl-2-pyridinyl)methyl]-1H-pyrimidin-6-one IUPAC Name: 2-[4-(5-bromo-3-methylpyridin-2-yl)butylamino]-5-[(5-methylpyridin-2-yl)methyl]-1H-pyrimidin-6-one Traditional Name: 2-[4-(5-bromo-3-methyl-2-pyridyl)butylamino]-5-[(5-methyl-2-pyridyl)methyl]-1H-pyrimidin-6-one Formula: C21H24BrN5O MolecularWeight: 442.35216

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C=C1)CC2=CN=C(NC2=O)NCCCCC3=NC=C(C=C3C)Br

Isomeric SMILES

CC1=CN=C(C=C1)CC2=CN=C(NC2=O)NCCCCC3=NC=C(C=C3C)Br

InChI

InChI=1S/C21H24BrN5O/c1-14-6-7-18(24-11-14)10-16-12-26-21(27-20(16)28)23-8-4-3-5-19-15(2)9-17(22)13-25-19/h6-7,9,11-13H,3-5,8,10H2,1-2H3,(H2,23,26,27,28)