BMRB

Biological Magnetic Resonance Data Bank


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

2,3-dihydro-1H-pyrido[2,3-b][1,4]thiazine

2,3-dihydro-1H-pyrido[2,3-b][1,4]thiazine bmse012213 - Data

2,3-dihydro-1H-pyrido[2,3-b][1,4]thiazine synonyms

Wikipedia:

Graphical representations:

2,3-dihydro-1H-pyrido[2,3-b][1,4]thiazine

View large 3D structure

Molecular Formula: C7H8N2S

Natural Isotopic Abundance Mass: 152.21681999999998

Mono-Isotopic Molecular Masses:

  • C12N14: 152.040819266
  • C13N14: 159.06430313200002
  • C12N15: 154.034889052
  • C13N15: 161.05837291800003

InChI string: InChI=1S/C7H8N2S/c1-2-6-7(9-3-1)10-5-4-8-6/h1-3,8H,4-5H2

IUPAC: b'2,3-dihydro-1H-pyrido[2,3-b][1,4]thiazine'

EU-OPENSCREEN: EOS102946

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)