BMRB

Biological Magnetic Resonance Data Bank


A Repository for Data from NMR Spectroscopy on Proteins, Peptides, Nucleic Acids, and other Biomolecules 		Member of WWPDB

N-pyridin-3-ylmethanesulfonamide

N-pyridin-3-ylmethanesulfonamide bmse011925 - Data

N-pyridin-3-ylmethanesulfonamide synonyms

Wikipedia:

Graphical representations:

N-pyridin-3-ylmethanesulfonamide

View large 3D structure

Molecular Formula: C6H8N2O2S

Natural Isotopic Abundance Mass: 172.20492

Mono-Isotopic Molecular Masses:

  • C12N14: 172.030648506
  • C13N14: 178.05077753400002
  • C12N15: 174.02471829200002
  • C13N15: 180.04484732000003

InChI string: InChI=1S/C6H8N2O2S/c1-11(9,10)8-6-3-2-4-7-5-6/h2-5,8H,1H3

IUPAC: b'N-pyridin-3-ylmethanesulfonamide'

EU-OPENSCREEN: EOS102635

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)