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

Systemtic Name: 2-[4-(5-bromanyl-3-methyl-pyridin-2-yl)butylamino]-5-[(4-fluorophenyl)methyl]-1H-pyrimidin-6-one Openeye Name: 2-[4-(5-bromo-3-methyl-2-pyridyl)butylamino]-5-[(4-fluorophenyl)methyl]-1H-pyrimidin-6-one CAS Name: 2-[4-(5-bromo-3-methyl-2-pyridinyl)butylamino]-5-[(4-fluorophenyl)methyl]-1H-pyrimidin-6-one IUPAC Name: 2-[4-(5-bromo-3-methylpyridin-2-yl)butylamino]-5-[(4-fluorophenyl)methyl]-1H-pyrimidin-6-one Traditional Name: 2-[4-(5-bromo-3-methyl-2-pyridyl)butylamino]-5-(4-fluorobenzyl)-1H-pyrimidin-6-one Formula: C21H22BrFN4O MolecularWeight: 445.327983

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22BrFN4O/c1-14-10-17(22)13-25-19(14)4-2-3-9-24-21-26-12-16(20(28)27-21)11-15-5-7-18(23)8-6-15/h5-8,10,12-13H,2-4,9,11H2,1H3,(H2,24,26,27,28)