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Substance Name: Pyridinium, 2-(((3-chlorophenyl)dithio)methyl)-4-methoxy-3-methyl-1-(1,5,6,7-tetrahydro-5,5,7,7-tetramethyl-6-oxoindeno(5,6-d)imidazol-2-yl)-, chloride
RN: 124473-39-8
InChIKey: BIIWSJODXLMNCZ-UHFFFAOYSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C28-H29-Cl-N3-O2-S2.Cl

Molecular Weight

  • 574.5941
 
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Names and Synonyms

  • Pyridinium, 2-(((3-chlorophenyl)dithio)methyl)-4-methoxy-3-methyl-1-(1,5,6,7-tetrahydro-5,5,7,7-tetramethyl-6-oxoindeno(5,6-d)imidazol-2-yl)-, chloride

Registry Numbers

CAS Registry Number

  • 124473-39-8

System Generated Number

  • 0124473398

Molecular Formulas

Molecular Formula

  • C28-H29-Cl-N3-O2-S2.Cl

Molecular Formula Fragments

  • C28-H29-Cl-N3-O2-S2
  • Cl
  • COMPONENT

Structure Descriptors

InChI

1S/C28H29ClN3O2S2.ClH/c1-16-23(15-35-36-18-9-7-8-17(29)12-18)32(11-10-24(16)34-6)26-30-21-13-19-20(14-22(21)31-26)28(4,5)25(33)27(19,2)3;/h7-14H,15H2,1-6H3,(H,30,31);1H/q+1;/p-1

InChIKey

BIIWSJODXLMNCZ-UHFFFAOYSA-M

Smiles

Cc1c(cc[n+](c1CSSc2cccc(c2)Cl)c3[nH]c4cc5c(cc4n3)C(C(=O)C5(C)C)(C)C)OC.[Cl-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 1250mg/kg (1250mg/kg)   United States Patent Document. Vol. #4766133,