2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-2-phenyl-ethanoic acid

Systemtic Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-2-phenyl-ethanoic acid Openeye Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-2-phenyl-acetic acid CAS Name: 2-[(4,6-dimethyl-2-pyrimidinyl)thio]-2-phenylacetic acid IUPAC Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-2-phenylacetic acid Traditional Name: 2-[(4,6-dimethylpyrimidin-2-yl)thio]-2-phenyl-acetic acid Formula: C14H14N2O2S MolecularWeight: 274.33816

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SC(C2=CC=CC=C2)C(=O)O)C

Isomeric SMILES

CC1=CC(=NC(=N1)SC(C2=CC=CC=C2)C(=O)O)C

InChI

InChI=1S/C14H14N2O2S/c1-9-8-10(2)16-14(15-9)19-12(13(17)18)11-6-4-3-5-7-11/h3-8,12H,1-2H3,(H,17,18)