• 
  [Synonyms]
  BRN 1654909
  LS-66028
  5-Picoline, 2-(5-ethylaminopentyloxy)-, hydrogen thiosulfate
  Ethanethiosulfuric acid, 2-(5-(5-methyl-2-pyridyloxy)pentyl)amino-
  S-2-((5-(5-Methyl-2-pyridyloxy)pentyl)amino)ethyl hydrogen thiosulfate
  Thiosulfuric acid, S-(2-((5-(5-methyl-2-pyridyloxy)pentyl)amino)ethyl) ester
  Ethanethiol, 2-(5-(5-methyl-2-pyridyloxy)pentyl)amino-, hydrogen sulfate (ester)
  41287-11-0
  
  [Structure]
  
  
  
  [ Properties Computed from Structure]
  

  Molecular Weight	334.45478 [g/mol]
  Molecular Formula	C13H22N2O4S2
  XLogP	1.4
  H-Bond Donor	2
  H-Bond Acceptor	6
  Rotatable Bond Count	11
  Exact Mass	334.102099
  MonoIsotopic Mass	334.102099
  Topological Polar Surface Area	88.5
  Heavy Atom Count	21
  Formal Charge	0
  Complexity	360
  Isotope Atom Count	0
  Defined Atom StereoCenter Count	0
  Undefined Atom StereoCenter Count	0
  Defined Bond StereoCenter Count	0
  Undefined Bond StereoCenter Count	0
  Covalently-Bonded Unit Count	1

  
  [ Descriptors Computed from Structure]
  IUPAC Name: 5-methyl-2-[5-(2-sulfosulfanylethylamino)pentoxy]pyridine
  Canonical SMILES: CC1=CN=C(C=C1)OCCCCCNCCSS(=O)(=O)O
  InChI: InChI=1/C13H22N2O4S2/c1-12-5-6-13(15-11-12)19-9-4-2-3-7-14-8-10-20-21
  (16,17)18/h5-6,11,14H,2-4,7-10H2,1H3,(H,16,17,18)/f/h16H