2-[3-[(5-bromanylpyrimidin-2-yl)-methyl-amino]propylamino]-5-[(6-methylpyridin-3-yl)methyl]-1H-pyrimidin-6-one

Systemtic Name: 2-[3-[(5-bromanylpyrimidin-2-yl)-methyl-amino]propylamino]-5-[(6-methylpyridin-3-yl)methyl]-1H-pyrimidin-6-one Openeye Name: 2-[3-[(5-bromopyrimidin-2-yl)-methyl-amino]propylamino]-5-[(6-methyl-3-pyridyl)methyl]-1H-pyrimidin-6-one CAS Name: 2-[3-[(5-bromo-2-pyrimidinyl)-methylamino]propylamino]-5-[(6-methyl-3-pyridinyl)methyl]-1H-pyrimidin-6-one IUPAC Name: 2-[3-[(5-bromopyrimidin-2-yl)-methylamino]propylamino]-5-[(6-methylpyridin-3-yl)methyl]-1H-pyrimidin-6-one Traditional Name: 2-[3-[(5-bromopyrimidin-2-yl)-methyl-amino]propylamino]-5-[(6-methyl-3-pyridyl)methyl]-1H-pyrimidin-6-one Formula: C19H22BrN7O MolecularWeight: 444.32828

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C=C1)CC2=CN=C(NC2=O)NCCCN(C)C3=NC=C(C=N3)Br

Isomeric SMILES

CC1=NC=C(C=C1)CC2=CN=C(NC2=O)NCCCN(C)C3=NC=C(C=N3)Br

InChI

InChI=1S/C19H22BrN7O/c1-13-4-5-14(9-22-13)8-15-10-23-18(26-17(15)28)21-6-3-7-27(2)19-24-11-16(20)12-25-19/h4-5,9-12H,3,6-8H2,1-2H3,(H2,21,23,26,28)