(2R)-2-(3-cyano-4,6-diphenyl-pyridin-2-yl)sulfanyl-2-phenyl-ethanoate

Systemtic Name: (2R)-2-(3-cyano-4,6-diphenyl-pyridin-2-yl)sulfanyl-2-phenyl-ethanoate Openeye Name: (2R)-2-[(3-cyano-4,6-diphenyl-2-pyridyl)sulfanyl]-2-phenyl-acetate CAS Name: (2R)-2-[(3-cyano-4,6-diphenyl-2-pyridinyl)thio]-2-phenylacetate IUPAC Name: (2R)-2-(3-cyano-4,6-diphenylpyridin-2-yl)sulfanyl-2-phenylacetate Traditional Name: (2R)-2-[(3-cyano-4,6-diphenyl-2-pyridyl)thio]-2-phenyl-acetate Formula: C26H17N2O2S- MolecularWeight: 421.49038

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=NC(=C2C#N)SC(C3=CC=CC=C3)C(=O)[O-])C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=NC(=C2C#N)S[C@H](C3=CC=CC=C3)C(=O)[O-])C4=CC=CC=C4

InChI

InChI=1S/C26H18N2O2S/c27-17-22-21(18-10-4-1-5-11-18)16-23(19-12-6-2-7-13-19)28-25(22)31-24(26(29)30)20-14-8-3-9-15-20/h1-16,24H,(H,29,30)/p-1/t24-/m1/s1