Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Pyridinium, 3,3'-(terephthaloylbis(imino(3-methyl-p-phenylene)carbonylimino))bis(1-methyl-, di-p-toluenesulfonate
RN: 19083-77-3
InChIKey: PPMCJWLBCLGTTF-UHFFFAOYSA-N

Classification Codes

  • Drug / Therapeutic Agent
  • Mutation Data

Molecular Formula

  • C36-H34-N6-O4.2C7-H7-O3-S

Molecular Weight

  • 957.093
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

  • Pyridinium, 3,3'-(terephthaloylbis(imino(3-methyl-p-phenylene)carbonylimino))bis(1-methyl-, di-p-toluenesulfonate

Registry Numbers

CAS Registry Number

  • 19083-77-3

System Generated Number

  • 0019083773

Molecular Formulas

Molecular Formula

  • C36-H34-N6-O4.2C7-H7-O3-S

Molecular Formula Fragments

  • C36-H34-N6-O4
  • C7-H7-O3-S
  • COMPONENT

Structure Descriptors

InChI

1S/C36H32N6O4.2C7H8O3S/c1-23-19-27(35(45)37-29-7-5-17-41(3)21-29)13-15-31(23)39-33(43)25-9-11-26(12-10-25)34(44)40-32-16-14-28(20-24(32)2)36(46)38-30-8-6-18-42(4)22-30;2*1-6-2-4-7(5-3-6)11(8,9)10/h5-22H,1-4H3,(H2-2,37,38,39,40,43,44,45,46);2*2-5H,1H3,(H,8,9,10)

InChIKey

PPMCJWLBCLGTTF-UHFFFAOYSA-N

Smiles

c1(ccc(cc1)C(=O)Nc1c(cc(cc1)C(=O)Nc1c[n+](ccc1)C)C)C(=O)Nc1c(cc(cc1)C(=O)Nc1c[n+](C)ccc1)C.c1(ccc(cc1)C)S(=O)(=O)[O-].c1(ccc(cc1)C)S(=O)(=O)[O-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD10 intraperitoneal 40mg/kg (40mg/kg)   Journal of Medicinal Chemistry. Vol. 22, Pg. 134, 1979.