(2R)-2-(3-cyano-6-phenyl-pyridin-2-yl)sulfanyl-2-phenyl-ethanoate

Systemtic Name: (2R)-2-(3-cyano-6-phenyl-pyridin-2-yl)sulfanyl-2-phenyl-ethanoate Openeye Name: (2R)-2-[(3-cyano-6-phenyl-2-pyridyl)sulfanyl]-2-phenyl-acetate CAS Name: (2R)-2-[(3-cyano-6-phenyl-2-pyridinyl)thio]-2-phenylacetate IUPAC Name: (2R)-2-(3-cyano-6-phenylpyridin-2-yl)sulfanyl-2-phenylacetate Traditional Name: (2R)-2-[(3-cyano-6-phenyl-2-pyridyl)thio]-2-phenyl-acetate Formula: C20H13N2O2S- MolecularWeight: 345.39442

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=C(C=C2)C#N)SC(C3=CC=CC=C3)C(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=C(C=C2)C#N)S[C@H](C3=CC=CC=C3)C(=O)[O-]

InChI

InChI=1S/C20H14N2O2S/c21-13-16-11-12-17(14-7-3-1-4-8-14)22-19(16)25-18(20(23)24)15-9-5-2-6-10-15/h1-12,18H,(H,23,24)/p-1/t18-/m1/s1