5-[(4-methoxyphenyl)methyl]-2-[2-[(3-methoxypyridin-2-yl)methylsulfanyl]ethylamino]-1H-pyrimidin-6-one

Systemtic Name: 5-[(4-methoxyphenyl)methyl]-2-[2-[(3-methoxypyridin-2-yl)methylsulfanyl]ethylamino]-1H-pyrimidin-6-one Openeye Name: 5-[(4-methoxyphenyl)methyl]-2-[2-[(3-methoxy-2-pyridyl)methylsulfanyl]ethylamino]-1H-pyrimidin-6-one CAS Name: 5-[(4-methoxyphenyl)methyl]-2-[2-[(3-methoxy-2-pyridinyl)methylthio]ethylamino]-1H-pyrimidin-6-one IUPAC Name: 5-[(4-methoxyphenyl)methyl]-2-[2-[(3-methoxypyridin-2-yl)methylsulfanyl]ethylamino]-1H-pyrimidin-6-one Traditional Name: 2-[2-[(3-methoxy-2-pyridyl)methylthio]ethylamino]-5-p-anisyl-1H-pyrimidin-6-one Formula: C21H24N4O3S MolecularWeight: 412.50526

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC2=CN=C(NC2=O)NCCSCC3=C(C=CC=N3)OC

Isomeric SMILES

COC1=CC=C(C=C1)CC2=CN=C(NC2=O)NCCSCC3=C(C=CC=N3)OC

InChI

InChI=1S/C21H24N4O3S/c1-27-17-7-5-15(6-8-17)12-16-13-24-21(25-20(16)26)23-10-11-29-14-18-19(28-2)4-3-9-22-18/h3-9,13H,10-12,14H2,1-2H3,(H2,23,24,25,26)