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Substance Name: Mkt 077
RN: 147366-41-4
InChIKey: VSKYOTRJSLYFHX-UXJRWBAGSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H22-N3-O-S2.Cl

Molecular Weight

  • 432.01
 
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Names and Synonyms

Name of Substance

  • MKT 077

Synonyms

  • FJ 776
  • MKT 077

Systematic Name

  • Pyridinium, 1-ethyl-2-((3-ethyl-5-(3-methyl-2(3H)-benzothiazolylidene)-4-oxo-2-thiazolidinylidene)methyl)-, chloride

Registry Numbers

CAS Registry Number

  • 147366-41-4

System Generated Number

  • 0147366414

Molecular Formulas

Molecular Formula

  • C21-H22-N3-O-S2.Cl

Molecular Formula Fragments

  • C21-H22-N3-O-S2
  • Cl
  • COMPONENT

Structure Descriptors

InChI

1S/C21H22N3OS2.ClH/c1-4-23-13-9-8-10-15(23)14-18-24(5-2)20(25)19(27-18)21-22(3)16-11-6-7-12-17(16)26-21;/h6-14H,4-5H2,1-3H3;1H/q+1;/p-1/b21-19+;

InChIKey

VSKYOTRJSLYFHX-UXJRWBAGSA-M

Smiles

c1(cccc[n+]1CC)\C=c1/sc(\c(n1CC)=O)=C1/Sc2c(N1C)cccc2.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 50mg/kg (50mg/kg)   Journal of Medicinal Chemistry. Vol. 41, Pg. 130, 1998.
mouse LD50 intravenous 20mg/kg (20mg/kg)   Journal of Medicinal Chemistry. Vol. 41, Pg. 130, 1998.