2-(3-cyano-6-thiophen-2-yl-pyridin-2-yl)sulfanyl-2-phenyl-ethanoic acid

Systemtic Name: 2-(3-cyano-6-thiophen-2-yl-pyridin-2-yl)sulfanyl-2-phenyl-ethanoic acid Openeye Name: 2-[[3-cyano-6-(2-thienyl)-2-pyridyl]sulfanyl]-2-phenyl-acetic acid CAS Name: 2-[(3-cyano-6-thiophen-2-yl-2-pyridinyl)thio]-2-phenylacetic acid IUPAC Name: 2-(3-cyano-6-thiophen-2-ylpyridin-2-yl)sulfanyl-2-phenylacetic acid Traditional Name: 2-[[3-cyano-6-(2-thienyl)-2-pyridyl]thio]-2-phenyl-acetic acid Formula: C18H12N2O2S2 MolecularWeight: 352.43008

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(=O)O)SC2=C(C=CC(=N2)C3=CC=CS3)C#N

Isomeric SMILES

C1=CC=C(C=C1)C(C(=O)O)SC2=C(C=CC(=N2)C3=CC=CS3)C#N

InChI

InChI=1S/C18H12N2O2S2/c19-11-13-8-9-14(15-7-4-10-23-15)20-17(13)24-16(18(21)22)12-5-2-1-3-6-12/h1-10,16H,(H,21,22)