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

Systemtic Name: 5-[(4-methoxyphenyl)methyl]-2-[2-[(3-methylpyridin-2-yl)methylsulfanyl]ethylamino]-1H-pyrimidin-6-one Openeye Name: 5-[(4-methoxyphenyl)methyl]-2-[2-[(3-methyl-2-pyridyl)methylsulfanyl]ethylamino]-1H-pyrimidin-6-one CAS Name: 5-[(4-methoxyphenyl)methyl]-2-[2-[(3-methyl-2-pyridinyl)methylthio]ethylamino]-1H-pyrimidin-6-one IUPAC Name: 5-[(4-methoxyphenyl)methyl]-2-[2-[(3-methylpyridin-2-yl)methylsulfanyl]ethylamino]-1H-pyrimidin-6-one Traditional Name: 2-[2-[(3-methyl-2-pyridyl)methylthio]ethylamino]-5-p-anisyl-1H-pyrimidin-6-one Formula: C21H24N4O2S MolecularWeight: 396.50586

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CC=C1)CSCCNC2=NC=C(C(=O)N2)CC3=CC=C(C=C3)OC

Isomeric SMILES

CC1=C(N=CC=C1)CSCCNC2=NC=C(C(=O)N2)CC3=CC=C(C=C3)OC

InChI

InChI=1S/C21H24N4O2S/c1-15-4-3-9-22-19(15)14-28-11-10-23-21-24-13-17(20(26)25-21)12-16-5-7-18(27-2)8-6-16/h3-9,13H,10-12,14H2,1-2H3,(H2,23,24,25,26)