5-(4,6-dimethoxypyrimidin-2-yl)oxy-3-methoxycarbonyl-2-methyl-1-benzothiophene-4-carboxylic acid

Systemtic Name: 5-(4,6-dimethoxypyrimidin-2-yl)oxy-3-methoxycarbonyl-2-methyl-1-benzothiophene-4-carboxylic acid Openeye Name: 5-(4,6-dimethoxypyrimidin-2-yl)oxy-3-methoxycarbonyl-2-methyl-benzothiophene-4-carboxylic acid CAS Name: 5-[(4,6-dimethoxy-2-pyrimidinyl)oxy]-3-methoxycarbonyl-2-methyl-1-benzothiophene-4-carboxylic acid IUPAC Name: 5-(4,6-dimethoxypyrimidin-2-yl)oxy-3-methoxycarbonyl-2-methyl-1-benzothiophene-4-carboxylic acid Traditional Name: 3-carbomethoxy-5-(4,6-dimethoxypyrimidin-2-yl)oxy-2-methyl-benzothiophene-4-carboxylic acid Formula: C18H16N2O7S MolecularWeight: 404.39384

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(S1)C=CC(=C2C(=O)O)OC3=NC(=CC(=N3)OC)OC)C(=O)OC

Isomeric SMILES

CC1=C(C2=C(S1)C=CC(=C2C(=O)O)OC3=NC(=CC(=N3)OC)OC)C(=O)OC

InChI

InChI=1S/C18H16N2O7S/c1-8-13(17(23)26-4)15-10(28-8)6-5-9(14(15)16(21)22)27-18-19-11(24-2)7-12(20-18)25-3/h5-7H,1-4H3,(H,21,22)