2-(4,6-dimethoxypyrimidin-2-yl)sulfanyl-6-phenoxy-benzoic acid

Systemtic Name: 2-(4,6-dimethoxypyrimidin-2-yl)sulfanyl-6-phenoxy-benzoic acid Openeye Name: 2-(4,6-dimethoxypyrimidin-2-yl)sulfanyl-6-phenoxy-benzoic acid CAS Name: 2-[(4,6-dimethoxy-2-pyrimidinyl)thio]-6-phenoxybenzoic acid IUPAC Name: 2-(4,6-dimethoxypyrimidin-2-yl)sulfanyl-6-phenoxybenzoic acid Traditional Name: 2-[(4,6-dimethoxypyrimidin-2-yl)thio]-6-phenoxy-benzoic acid Formula: C19H16N2O5S MolecularWeight: 384.40574

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=NC(=N1)SC2=CC=CC(=C2C(=O)O)OC3=CC=CC=C3)OC

Isomeric SMILES

COC1=CC(=NC(=N1)SC2=CC=CC(=C2C(=O)O)OC3=CC=CC=C3)OC

InChI

InChI=1S/C19H16N2O5S/c1-24-15-11-16(25-2)21-19(20-15)27-14-10-6-9-13(17(14)18(22)23)26-12-7-4-3-5-8-12/h3-11H,1-2H3,(H,22,23)