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

Systemtic Name: 2-[4-(5-bromanyl-3-methyl-pyridin-2-yl)butylamino]-5-[[6-(hydroxymethyl)-5-methyl-pyridin-3-yl]methyl]-1H-pyrimidin-6-one Openeye Name: 2-[4-(5-bromo-3-methyl-2-pyridyl)butylamino]-5-[[6-(hydroxymethyl)-5-methyl-3-pyridyl]methyl]-1H-pyrimidin-6-one CAS Name: 2-[4-(5-bromo-3-methyl-2-pyridinyl)butylamino]-5-[[6-(hydroxymethyl)-5-methyl-3-pyridinyl]methyl]-1H-pyrimidin-6-one IUPAC Name: 2-[4-(5-bromo-3-methylpyridin-2-yl)butylamino]-5-[[6-(hydroxymethyl)-5-methylpyridin-3-yl]methyl]-1H-pyrimidin-6-one Traditional Name: 2-[4-(5-bromo-3-methyl-2-pyridyl)butylamino]-5-[(5-methyl-6-methylol-3-pyridyl)methyl]-1H-pyrimidin-6-one Formula: C22H26BrN5O2 MolecularWeight: 472.37814

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H26BrN5O2/c1-14-7-16(10-25-20(14)13-29)9-17-11-27-22(28-21(17)30)24-6-4-3-5-19-15(2)8-18(23)12-26-19/h7-8,10-12,29H,3-6,9,13H2,1-2H3,(H2,24,27,28,30)