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

Systemtic Name: 5-(4,5-dimethoxy-3-oxidanylidene-1H-2-benzofuran-1-yl)-6-oxidanyl-1-phenyl-2-sulfanylidene-pyrimidin-4-one Openeye Name: 5-(4,5-dimethoxy-3-oxo-1H-isobenzofuran-1-yl)-6-hydroxy-1-phenyl-2-thioxo-pyrimidin-4-one CAS Name: 5-(4,5-dimethoxy-3-oxo-1H-isobenzofuran-1-yl)-6-hydroxy-1-phenyl-2-sulfanylidene-4-pyrimidinone IUPAC Name: 5-(4,5-dimethoxy-3-oxo-1H-2-benzofuran-1-yl)-6-hydroxy-1-phenyl-2-sulfanylidenepyrimidin-4-one Traditional Name: 6-hydroxy-5-(3-keto-4,5-dimethoxy-phthalan-1-yl)-1-phenyl-2-thioxo-pyrimidin-4-one Formula: C20H16N2O6S MolecularWeight: 412.41584

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=C(C=C1)C(OC2=O)C3=C(N(C(=S)NC3=O)C4=CC=CC=C4)O)OC

Isomeric SMILES

COC1=C(C2=C(C=C1)C(OC2=O)C3=C(N(C(=S)NC3=O)C4=CC=CC=C4)O)OC

InChI

InChI=1S/C20H16N2O6S/c1-26-12-9-8-11-13(16(12)27-2)19(25)28-15(11)14-17(23)21-20(29)22(18(14)24)10-6-4-3-5-7-10/h3-9,15,24H,1-2H3,(H,21,23,29)