2-[(4-methoxyphenyl)methylsulfanyl]-4-oxidanyl-5-[(4-propan-2-yloxyphenyl)methyl]-1H-pyrimidin-6-one

Systemtic Name: 2-[(4-methoxyphenyl)methylsulfanyl]-4-oxidanyl-5-[(4-propan-2-yloxyphenyl)methyl]-1H-pyrimidin-6-one Openeye Name: 4-hydroxy-5-[(4-isopropoxyphenyl)methyl]-2-[(4-methoxyphenyl)methylsulfanyl]-1H-pyrimidin-6-one CAS Name: 4-hydroxy-2-[(4-methoxyphenyl)methylthio]-5-[(4-propan-2-yloxyphenyl)methyl]-1H-pyrimidin-6-one IUPAC Name: 4-hydroxy-2-[(4-methoxyphenyl)methylsulfanyl]-5-[(4-propan-2-yloxyphenyl)methyl]-1H-pyrimidin-6-one Traditional Name: 4-hydroxy-5-(4-isopropoxybenzyl)-2-(p-anisylthio)-1H-pyrimidin-6-one Formula: C22H24N2O4S MolecularWeight: 412.50196

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)CC2=C(N=C(NC2=O)SCC3=CC=C(C=C3)OC)O

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)CC2=C(N=C(NC2=O)SCC3=CC=C(C=C3)OC)O

InChI

InChI=1S/C22H24N2O4S/c1-14(2)28-18-10-4-15(5-11-18)12-19-20(25)23-22(24-21(19)26)29-13-16-6-8-17(27-3)9-7-16/h4-11,14H,12-13H2,1-3H3,(H2,23,24,25,26)