7-(4,6-dimethoxypyrimidin-2-yl)sulfanyl-3H-2-benzofuran-1-one

Systemtic Name: 7-(4,6-dimethoxypyrimidin-2-yl)sulfanyl-3H-2-benzofuran-1-one Openeye Name: 7-(4,6-dimethoxypyrimidin-2-yl)sulfanyl-3H-isobenzofuran-1-one CAS Name: 7-[(4,6-dimethoxy-2-pyrimidinyl)thio]-3H-isobenzofuran-1-one IUPAC Name: 7-(4,6-dimethoxypyrimidin-2-yl)sulfanyl-3H-2-benzofuran-1-one Traditional Name: 7-[(4,6-dimethoxypyrimidin-2-yl)thio]phthalide Formula: C14H12N2O4S MolecularWeight: 304.32108

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=NC(=N1)SC2=CC=CC3=C2C(=O)OC3)OC

Isomeric SMILES

COC1=CC(=NC(=N1)SC2=CC=CC3=C2C(=O)OC3)OC

InChI

InChI=1S/C14H12N2O4S/c1-18-10-6-11(19-2)16-14(15-10)21-9-5-3-4-8-7-20-13(17)12(8)9/h3-6H,7H2,1-2H3