5-[5-(trifluoromethyl)pyridin-2-yl]sulfanylpentanoic acid

Systemtic Name: 5-[5-(trifluoromethyl)pyridin-2-yl]sulfanylpentanoic acid Openeye Name: 5-[[5-(trifluoromethyl)-2-pyridyl]sulfanyl]pentanoic acid CAS Name: 5-[[5-(trifluoromethyl)-2-pyridinyl]thio]pentanoic acid IUPAC Name: 5-[5-(trifluoromethyl)pyridin-2-yl]sulfanylpentanoic acid Traditional Name: 5-[[5-(trifluoromethyl)-2-pyridyl]thio]valeric acid Formula: C11H12F3NO2S MolecularWeight: 279.27869

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=NC=C1C(F)(F)F)SCCCCC(=O)O

Isomeric SMILES

C1=CC(=NC=C1C(F)(F)F)SCCCCC(=O)O

InChI

InChI=1S/C11H12F3NO2S/c12-11(13,14)8-4-5-9(15-7-8)18-6-2-1-3-10(16)17/h4-5,7H,1-3,6H2,(H,16,17)