Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Chlorothen citrate [NF]
RN: 148-64-1
UNII: 0X60R85C0J
InChIKey: LLQVTRFPENCFFC-UHFFFAOYSA-N

Molecular Formula

  • C14-H18-Cl-N3-S.C6-H8-O7

Molecular Weight

  • 487.958
 
* denotes mobile formatted website

Links to Resources


Search for this InChIKey on the Web

Names and Synonyms

Name of Substance

  • Chlorothen citrate [NF]

Synonyms

  • 2-((5-Chloro-2-thenyl)(2-(dimethylamino)ethyl)amino)pyridine citrate (1:1)
  • Chlorothen citrate
  • EINECS 205-720-0
  • UNII-0X60R85C0J

Systematic Names

  • 1,2-Ethanediamine, N-((5-chloro-2-thienyl)methyl)-N',N'-dimethyl-N-2-pyridinyl-, 2-hydroxy-1,2,3-propanetricarboxylate (1:1)
  • 1,2-Ethanediamine, N1-((5-chloro-2-thienyl)methyl)-N2,N2-dimethyl-N1-2-pyridinyl-, 2-hydroxy-1,2,3-propanetricarboxylate (1:1)
  • 2-((5-Chloro-2-thenyl)(2-(dimethylamino)ethyl)amino)pyridine citrate (1:1)
  • N-((5-Chloro-2-thienyl)methyl)-N',N'-dimethyl-N-2-pyridylethylenediamine 2-hydroxy-1,2,3-propanetricarboxylate

Registry Numbers

CAS Registry Number

  • 148-64-1

FDA UNII

  • 0X60R85C0J

Other Registry Number

  • 37317-05-8

Related Registry Number

  • 148-65-2 (Parent)

System Generated Number

  • 0000148641

Molecular Formulas

Molecular Formula

  • C14-H18-Cl-N3-S.C6-H8-O7

Molecular Formula Fragments

  • C14-H18-Cl-N3-S
  • C6-H8-O7
  • COMPONENT

Structure Descriptors

InChI

1S/C14H18ClN3S.C6H8O7/c1-17(2)9-10-18(14-5-3-4-8-16-14)11-12-6-7-13(15)19-12;7-3(8)1-6(13,5(11)12)2-4(9)10/h3-8H,9-11H2,1-2H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)

InChIKey

LLQVTRFPENCFFC-UHFFFAOYSA-N

Smiles

n1ccccc1N(Cc1ccc(Cl)s1)CCN(C)C.C(CC(CC(O)=O)(C(O)=O)O)(O)=O