5-[(5-ethanoyl-2-methoxy-phenyl)methyl]-4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-6-olate

Systemtic Name: 5-[(5-ethanoyl-2-methoxy-phenyl)methyl]-4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-6-olate Openeye Name: 5-[(5-acetyl-2-methoxy-phenyl)methyl]-4-oxo-2-thioxo-1H-pyrimidin-6-olate CAS Name: 5-[(5-acetyl-2-methoxyphenyl)methyl]-4-oxo-2-sulfanylidene-1H-pyrimidin-6-olate IUPAC Name: 5-[(5-acetyl-2-methoxyphenyl)methyl]-4-oxo-2-sulfanylidene-1H-pyrimidin-6-olate Traditional Name: 5-(5-acetyl-2-methoxy-benzyl)-4-keto-2-thioxo-1H-pyrimidin-6-olate Formula: C14H13N2O4S- MolecularWeight: 305.32902

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)OC)CC2=C(NC(=S)NC2=O)[O-]

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)OC)CC2=C(NC(=S)NC2=O)[O-]

InChI

InChI=1S/C14H14N2O4S/c1-7(17)8-3-4-11(20-2)9(5-8)6-10-12(18)15-14(21)16-13(10)19/h3-5H,6H2,1-2H3,(H3,15,16,18,19,21)/p-1