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

Systemtic Name: 2-[4-(3-azanyl-5-bromanyl-pyridin-2-yl)butylamino]-5-[(6-methylpyridin-3-yl)methyl]-1H-pyrimidin-6-one Openeye Name: 2-[4-(3-amino-5-bromo-2-pyridyl)butylamino]-5-[(6-methyl-3-pyridyl)methyl]-1H-pyrimidin-6-one CAS Name: 2-[4-(3-amino-5-bromo-2-pyridinyl)butylamino]-5-[(6-methyl-3-pyridinyl)methyl]-1H-pyrimidin-6-one IUPAC Name: 2-[4-(3-amino-5-bromopyridin-2-yl)butylamino]-5-[(6-methylpyridin-3-yl)methyl]-1H-pyrimidin-6-one Traditional Name: 2-[4-(3-amino-5-bromo-2-pyridyl)butylamino]-5-[(6-methyl-3-pyridyl)methyl]-1H-pyrimidin-6-one Formula: C20H23BrN6O MolecularWeight: 443.34022

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C=C1)CC2=CN=C(NC2=O)NCCCCC3=NC=C(C=C3N)Br

Isomeric SMILES

CC1=NC=C(C=C1)CC2=CN=C(NC2=O)NCCCCC3=NC=C(C=C3N)Br

InChI

InChI=1S/C20H23BrN6O/c1-13-5-6-14(10-24-13)8-15-11-26-20(27-19(15)28)23-7-3-2-4-18-17(22)9-16(21)12-25-18/h5-6,9-12H,2-4,7-8,22H2,1H3,(H2,23,26,27,28)