2-[4-(3-bromanylpyridin-2-yl)butylamino]-5-(pyridin-3-ylmethyl)-1H-pyrimidin-6-one

Systemtic Name: 2-[4-(3-bromanylpyridin-2-yl)butylamino]-5-(pyridin-3-ylmethyl)-1H-pyrimidin-6-one Openeye Name: 2-[4-(3-bromo-2-pyridyl)butylamino]-5-(3-pyridylmethyl)-1H-pyrimidin-6-one CAS Name: 2-[4-(3-bromo-2-pyridinyl)butylamino]-5-(3-pyridinylmethyl)-1H-pyrimidin-6-one IUPAC Name: 2-[4-(3-bromopyridin-2-yl)butylamino]-5-(pyridin-3-ylmethyl)-1H-pyrimidin-6-one Traditional Name: 2-[4-(3-bromo-2-pyridyl)butylamino]-5-(3-pyridylmethyl)-1H-pyrimidin-6-one Formula: C19H20BrN5O MolecularWeight: 414.299

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CC2=CN=C(NC2=O)NCCCCC3=C(C=CC=N3)Br

Isomeric SMILES

C1=CC(=CN=C1)CC2=CN=C(NC2=O)NCCCCC3=C(C=CC=N3)Br

InChI

InChI=1S/C19H20BrN5O/c20-16-6-4-10-22-17(16)7-1-2-9-23-19-24-13-15(18(26)25-19)11-14-5-3-8-21-12-14/h3-6,8,10,12-13H,1-2,7,9,11H2,(H2,23,24,25,26)