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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC=C1CC2=CN=C(NC2=O)NCCCCC3=NC=C(C=C3C)Br)C

Isomeric SMILES

CC1=CC(=NC=C1CC2=CN=C(NC2=O)NCCCCC3=NC=C(C=C3C)Br)C

InChI

InChI=1S/C22H26BrN5O/c1-14-8-16(3)25-11-17(14)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)