2-[2-[(3-bromanylpyridin-2-yl)methylsulfanyl]ethylamino]-5-(1-pyridin-3-ylethyl)-1H-pyrimidin-6-one

Systemtic Name: 2-[2-[(3-bromanylpyridin-2-yl)methylsulfanyl]ethylamino]-5-(1-pyridin-3-ylethyl)-1H-pyrimidin-6-one Openeye Name: 2-[2-[(3-bromo-2-pyridyl)methylsulfanyl]ethylamino]-5-[1-(3-pyridyl)ethyl]-1H-pyrimidin-6-one CAS Name: 2-[2-[(3-bromo-2-pyridinyl)methylthio]ethylamino]-5-[1-(3-pyridinyl)ethyl]-1H-pyrimidin-6-one IUPAC Name: 2-[2-[(3-bromopyridin-2-yl)methylsulfanyl]ethylamino]-5-(1-pyridin-3-ylethyl)-1H-pyrimidin-6-one Traditional Name: 2-[2-[(3-bromo-2-pyridyl)methylthio]ethylamino]-5-[1-(3-pyridyl)ethyl]-1H-pyrimidin-6-one Formula: C19H20BrN5OS MolecularWeight: 446.364

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CN=CC=C1)C2=CN=C(NC2=O)NCCSCC3=C(C=CC=N3)Br

Isomeric SMILES

CC(C1=CN=CC=C1)C2=CN=C(NC2=O)NCCSCC3=C(C=CC=N3)Br

InChI

InChI=1S/C19H20BrN5OS/c1-13(14-4-2-6-21-10-14)15-11-24-19(25-18(15)26)23-8-9-27-12-17-16(20)5-3-7-22-17/h2-7,10-11,13H,8-9,12H2,1H3,(H2,23,24,25,26)