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

Systemtic Name: 2-[(5-ethanoyl-2-oxidanyl-phenyl)methylsulfanyl]-6-methyl-1H-pyrimidin-4-one Openeye Name: 2-[(5-acetyl-2-hydroxy-phenyl)methylsulfanyl]-6-methyl-1H-pyrimidin-4-one CAS Name: 2-[(5-acetyl-2-hydroxyphenyl)methylthio]-6-methyl-1H-pyrimidin-4-one IUPAC Name: 2-[(5-acetyl-2-hydroxyphenyl)methylsulfanyl]-6-methyl-1H-pyrimidin-4-one Traditional Name: 2-[(5-acetyl-2-hydroxy-benzyl)thio]-6-methyl-1H-pyrimidin-4-one Formula: C14H14N2O3S MolecularWeight: 290.33756

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N=C(N1)SCC2=C(C=CC(=C2)C(=O)C)O

Isomeric SMILES

CC1=CC(=O)N=C(N1)SCC2=C(C=CC(=C2)C(=O)C)O

InChI

InChI=1S/C14H14N2O3S/c1-8-5-13(19)16-14(15-8)20-7-11-6-10(9(2)17)3-4-12(11)18/h3-6,18H,7H2,1-2H3,(H,15,16,19)