3-piperidin-1-yl-5-thiophen-2-yl-1,2,4-oxadiazole

3-piperidin-1-yl-5-thiophen-2-yl-1,2,4-oxadiazole bmse011646 - Data

NMR Quality Control Of Fragment Libraries For Screening synonyms

Wikipedia:

Graphical representations:

NMR

View large 3D structure

Molecular Formula: C11H13N3OS

Natural Isotopic Abundance Mass: 235.30541999999988

Mono-Isotopic Molecular Masses:

  • C12N14: 235.077933051
  • C13N14: 246.11483626900005
  • C12N15: 238.06903773000002
  • C13N15: 249.10594094800007

InChI string: InChI=1S/C11H13N3OS/c1-2-6-14(7-3-1)11-12-10(15-13-11)9-5-4-8-16-9/h4-5,8H,1-3,6-7H2

Reference data were obtained primarily from the PubChem database.

Three dimensional molecular rendering uses Jmol.

InChI string and atom numbering calculated using ALATIS (Hesam Dashti, William M. Westler, John L. Markley, Hamid R. Eghbalnia, "Unique identifiers for small molecules enable rigorous labeling of their atoms", Scientific Data 4, Article number: 170073 (2017), doi:10.1038/sdata.2017.73, https://www.nature.com/articles/sdata201773)