2-phenyl-2-[5-(trifluoromethyl)pyridin-2-yl]sulfanyl-ethanoic acid

Systemtic Name: 2-phenyl-2-[5-(trifluoromethyl)pyridin-2-yl]sulfanyl-ethanoic acid Openeye Name: 2-phenyl-2-[[5-(trifluoromethyl)-2-pyridyl]sulfanyl]acetic acid CAS Name: 2-phenyl-2-[[5-(trifluoromethyl)-2-pyridinyl]thio]acetic acid IUPAC Name: 2-phenyl-2-[5-(trifluoromethyl)pyridin-2-yl]sulfanylacetic acid Traditional Name: 2-phenyl-2-[[5-(trifluoromethyl)-2-pyridyl]thio]acetic acid Formula: C14H10F3NO2S MolecularWeight: 313.29491

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(=O)O)SC2=NC=C(C=C2)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)C(C(=O)O)SC2=NC=C(C=C2)C(F)(F)F

InChI

InChI=1S/C14H10F3NO2S/c15-14(16,17)10-6-7-11(18-8-10)21-12(13(19)20)9-4-2-1-3-5-9/h1-8,12H,(H,19,20)