(2R)-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-2-phenyl-ethanoate

Systemtic Name: (2R)-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-2-phenyl-ethanoate Openeye Name: (2R)-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-2-phenyl-acetate CAS Name: (2R)-2-[(4,6-dimethyl-2-pyrimidinyl)thio]-2-phenylacetate IUPAC Name: (2R)-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-2-phenylacetate Traditional Name: (2R)-2-[(4,6-dimethylpyrimidin-2-yl)thio]-2-phenyl-acetate Formula: C14H13N2O2S- MolecularWeight: 273.33022

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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)S[C@H](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)/p-1/t12-/m1/s1