(2R)-2-(3,6-dimethylpyridin-2-yl)sulfanyl-2-phenyl-ethanoate

Systemtic Name: (2R)-2-(3,6-dimethylpyridin-2-yl)sulfanyl-2-phenyl-ethanoate Openeye Name: (2R)-2-[(3,6-dimethyl-2-pyridyl)sulfanyl]-2-phenyl-acetate CAS Name: (2R)-2-[(3,6-dimethyl-2-pyridinyl)thio]-2-phenylacetate IUPAC Name: (2R)-2-(3,6-dimethylpyridin-2-yl)sulfanyl-2-phenylacetate Traditional Name: (2R)-2-[(3,6-dimethyl-2-pyridyl)thio]-2-phenyl-acetate Formula: C15H14NO2S- MolecularWeight: 272.34216

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(C=C1)C)SC(C2=CC=CC=C2)C(=O)[O-]

Isomeric SMILES

CC1=C(N=C(C=C1)C)S[C@H](C2=CC=CC=C2)C(=O)[O-]

InChI

InChI=1S/C15H15NO2S/c1-10-8-9-11(2)16-14(10)19-13(15(17)18)12-6-4-3-5-7-12/h3-9,13H,1-2H3,(H,17,18)/p-1/t13-/m1/s1