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Substance Name: SN 6058
RN: 20719-27-1
InChIKey: XNHFZBWBSBEDPM-MBZUHOHVSA-N

Classification Codes

  • Drug / Therapeutic Agent
  • Mutation Data

Molecular Formulas

  • C32-H28-N6-O2.2C7-H8-O3-S
  • C32-H30-N6-O2.2C7-H7-O3-S

Molecular Weight

  • 873.02
 
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Names and Synonyms

Results Name

  • SN 6058

Systematic Name

  • Pyridinium, 2,2'-(terephthaloylbis(imino-p-phenyleneimino))bis(1-methyl-, di-p-toluenesulfonate

Registry Numbers

CAS Registry Number

  • 20719-27-1

System Generated Number

  • 0020719271

Molecular Formulas

Molecular Formulas

  • C32-H28-N6-O2.2C7-H8-O3-S
  • C32-H30-N6-O2.2C7-H7-O3-S

Molecular Formula Fragments

  • C32-H28-N6-O2
  • C32-H30-N6-O2
  • C7-H7-O3-S
  • C7-H8-O3-S
  • COMPONENT

Structure Descriptors

InChI

1S/C32H28N6O2.2C7H8O3S/c1-37-21-5-3-7-29(37)33-25-13-17-27(18-14-25)35-31(39)23-9-11-24(12-10-23)32(40)36-28-19-15-26(16-20-28)34-30-8-4-6-22-38(30)2;2*1-6-2-4-7(5-3-6)11(8,9)10/h3-22H,1-2H3,(H,35,39)(H,36,40);2*2-5H,1H3,(H,8,9,10)/b33-29-,34-30-;;

InChIKey

XNHFZBWBSBEDPM-MBZUHOHVSA-N

Smiles

c1(ccc(cc1)C(=O)Nc1ccc(cc1)\N=c1\ccccn1C)C(=O)Nc1ccc(\N=c2/n(cccc2)C)cc1.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 16mg/kg (16mg/kg)   Journal of Medicinal Chemistry. Vol. 22, Pg. 134, 1979.