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

Systemtic Name: 2-[(5-ethanoyl-2-ethoxy-phenyl)-sulfanyl-methyl]-4-oxidanyl-1H-pyrimidin-6-one Openeye Name: 2-[(5-acetyl-2-ethoxy-phenyl)-sulfanyl-methyl]-4-hydroxy-1H-pyrimidin-6-one CAS Name: 2-[(5-acetyl-2-ethoxyphenyl)-mercaptomethyl]-4-hydroxy-1H-pyrimidin-6-one IUPAC Name: 2-[(5-acetyl-2-ethoxyphenyl)-sulfanylmethyl]-4-hydroxy-1H-pyrimidin-6-one Traditional Name: 2-[(5-acetyl-2-ethoxy-phenyl)-mercapto-methyl]-4-hydroxy-1H-pyrimidin-6-one Formula: C15H16N2O4S MolecularWeight: 320.36354

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)C)C(C2=NC(=CC(=O)N2)O)S

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)C)C(C2=NC(=CC(=O)N2)O)S

InChI

InChI=1S/C15H16N2O4S/c1-3-21-11-5-4-9(8(2)18)6-10(11)14(22)15-16-12(19)7-13(20)17-15/h4-7,14,22H,3H2,1-2H3,(H2,16,17,19,20)