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

Systemtic Name: 5-(4,5-dimethoxy-3-oxidanylidene-1H-2-benzofuran-1-yl)-1-(2-methylphenyl)-6-oxidanyl-2-sulfanylidene-pyrimidin-4-one Openeye Name: 5-(4,5-dimethoxy-3-oxo-1H-isobenzofuran-1-yl)-6-hydroxy-1-(o-tolyl)-2-thioxo-pyrimidin-4-one CAS Name: 5-(4,5-dimethoxy-3-oxo-1H-isobenzofuran-1-yl)-6-hydroxy-1-(2-methylphenyl)-2-sulfanylidene-4-pyrimidinone IUPAC Name: 5-(4,5-dimethoxy-3-oxo-1H-2-benzofuran-1-yl)-6-hydroxy-1-(2-methylphenyl)-2-sulfanylidenepyrimidin-4-one Traditional Name: 6-hydroxy-5-(3-keto-4,5-dimethoxy-phthalan-1-yl)-1-(o-tolyl)-2-thioxo-pyrimidin-4-one Formula: C21H18N2O6S MolecularWeight: 426.44242

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=C(C(=O)NC2=S)C3C4=C(C(=C(C=C4)OC)OC)C(=O)O3)O

Isomeric SMILES

CC1=CC=CC=C1N2C(=C(C(=O)NC2=S)C3C4=C(C(=C(C=C4)OC)OC)C(=O)O3)O

InChI

InChI=1S/C21H18N2O6S/c1-10-6-4-5-7-12(10)23-19(25)15(18(24)22-21(23)30)16-11-8-9-13(27-2)17(28-3)14(11)20(26)29-16/h4-9,16,25H,1-3H3,(H,22,24,30)