5-[(4-methoxyphenyl)methyl]-6-methyl-2-(phenylmethylsulfanyl)-1H-pyrimidin-4-one

Systemtic Name: 5-[(4-methoxyphenyl)methyl]-6-methyl-2-(phenylmethylsulfanyl)-1H-pyrimidin-4-one Openeye Name: 2-benzylsulfanyl-5-[(4-methoxyphenyl)methyl]-6-methyl-1H-pyrimidin-4-one CAS Name: 5-[(4-methoxyphenyl)methyl]-6-methyl-2-(phenylmethylthio)-1H-pyrimidin-4-one IUPAC Name: 2-benzylsulfanyl-5-[(4-methoxyphenyl)methyl]-6-methyl-1H-pyrimidin-4-one Traditional Name: 2-(benzylthio)-6-methyl-5-p-anisyl-1H-pyrimidin-4-one Formula: C20H20N2O2S MolecularWeight: 352.45

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)SCC2=CC=CC=C2)CC3=CC=C(C=C3)OC

Isomeric SMILES

CC1=C(C(=O)N=C(N1)SCC2=CC=CC=C2)CC3=CC=C(C=C3)OC

InChI

InChI=1S/C20H20N2O2S/c1-14-18(12-15-8-10-17(24-2)11-9-15)19(23)22-20(21-14)25-13-16-6-4-3-5-7-16/h3-11H,12-13H2,1-2H3,(H,21,22,23)