3-methyl-N-(1-methylpyrazol-3-yl)-1,2-oxazole-5-carboxamide

3-methyl-N-(1-methylpyrazol-3-yl)-1,2-oxazole-5-carboxamide bmse011217 - Data

NMR Quality Control Of Fragment Libraries For Screening synonyms

Wikipedia:

Graphical representations:

NMR

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Molecular Formula: C9H10N4O2

Natural Isotopic Abundance Mass: 206.20129999999992

Mono-Isotopic Molecular Masses:

  • C12N14: 206.08037558
  • C13N14: 215.11056912200004
  • C12N15: 210.06851515200003
  • C13N15: 219.09870869400007

InChI string: InChI=1S/C9H10N4O2/c1-6-5-7(15-12-6)9(14)10-8-3-4-13(2)11-8/h3-5H,1-2H3,(H,10,11,14)

wwPDB CCD: K0M

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)