5-(4,5-dimethoxy-3-oxidanylidene-1H-2-benzofuran-1-yl)-6-oxidanyl-2-sulfanylidene-1H-pyrimidin-4-one

Systemtic Name: 5-(4,5-dimethoxy-3-oxidanylidene-1H-2-benzofuran-1-yl)-6-oxidanyl-2-sulfanylidene-1H-pyrimidin-4-one Openeye Name: 5-(4,5-dimethoxy-3-oxo-1H-isobenzofuran-1-yl)-6-hydroxy-2-thioxo-1H-pyrimidin-4-one CAS Name: 5-(4,5-dimethoxy-3-oxo-1H-isobenzofuran-1-yl)-6-hydroxy-2-sulfanylidene-1H-pyrimidin-4-one IUPAC Name: 5-(4,5-dimethoxy-3-oxo-1H-2-benzofuran-1-yl)-6-hydroxy-2-sulfanylidene-1H-pyrimidin-4-one Traditional Name: 6-hydroxy-5-(3-keto-4,5-dimethoxy-phthalan-1-yl)-2-thioxo-1H-pyrimidin-4-one Formula: C14H12N2O6S MolecularWeight: 336.31988

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=C(C=C1)C(OC2=O)C3=C(NC(=S)NC3=O)O)OC

Isomeric SMILES

COC1=C(C2=C(C=C1)C(OC2=O)C3=C(NC(=S)NC3=O)O)OC

InChI

InChI=1S/C14H12N2O6S/c1-20-6-4-3-5-7(10(6)21-2)13(19)22-9(5)8-11(17)15-14(23)16-12(8)18/h3-4,9H,1-2H3,(H3,15,16,17,18,23)