2-(3-cyano-4-phenyl-6-thiophen-2-yl-pyridin-2-yl)sulfanyl-2-phenyl-ethanoic acid

Systemtic Name: 2-(3-cyano-4-phenyl-6-thiophen-2-yl-pyridin-2-yl)sulfanyl-2-phenyl-ethanoic acid Openeye Name: 2-[[3-cyano-4-phenyl-6-(2-thienyl)-2-pyridyl]sulfanyl]-2-phenyl-acetic acid CAS Name: 2-[(3-cyano-4-phenyl-6-thiophen-2-yl-2-pyridinyl)thio]-2-phenylacetic acid IUPAC Name: 2-(3-cyano-4-phenyl-6-thiophen-2-ylpyridin-2-yl)sulfanyl-2-phenylacetic acid Traditional Name: 2-[[3-cyano-4-phenyl-6-(2-thienyl)-2-pyridyl]thio]-2-phenyl-acetic acid Formula: C24H16N2O2S2 MolecularWeight: 428.52604

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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=CS4

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=NC(=C2C#N)SC(C3=CC=CC=C3)C(=O)O)C4=CC=CS4

InChI

InChI=1S/C24H16N2O2S2/c25-15-19-18(16-8-3-1-4-9-16)14-20(21-12-7-13-29-21)26-23(19)30-22(24(27)28)17-10-5-2-6-11-17/h1-14,22H,(H,27,28)