5-[[5-ethanoyl-2-(propan-2-yloxymethyl)phenyl]methyl]-2-methylsulfanyl-4-oxidanyl-1H-pyrimidin-6-one

Systemtic Name: 5-[[5-ethanoyl-2-(propan-2-yloxymethyl)phenyl]methyl]-2-methylsulfanyl-4-oxidanyl-1H-pyrimidin-6-one Openeye Name: 5-[[5-acetyl-2-(isopropoxymethyl)phenyl]methyl]-4-hydroxy-2-methylsulfanyl-1H-pyrimidin-6-one CAS Name: 5-[[5-acetyl-2-(propan-2-yloxymethyl)phenyl]methyl]-4-hydroxy-2-(methylthio)-1H-pyrimidin-6-one IUPAC Name: 5-[[5-acetyl-2-(propan-2-yloxymethyl)phenyl]methyl]-4-hydroxy-2-methylsulfanyl-1H-pyrimidin-6-one Traditional Name: 5-[5-acetyl-2-(isopropoxymethyl)benzyl]-4-hydroxy-2-(methylthio)-1H-pyrimidin-6-one Formula: C18H22N2O4S MolecularWeight: 362.44328

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCC1=C(C=C(C=C1)C(=O)C)CC2=C(N=C(NC2=O)SC)O

Isomeric SMILES

CC(C)OCC1=C(C=C(C=C1)C(=O)C)CC2=C(N=C(NC2=O)SC)O

InChI

InChI=1S/C18H22N2O4S/c1-10(2)24-9-13-6-5-12(11(3)21)7-14(13)8-15-16(22)19-18(25-4)20-17(15)23/h5-7,10H,8-9H2,1-4H3,(H2,19,20,22,23)