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Substance Name: as-Triazine, 5,6-bis(3,4-dimethoxyphenyl)-3-(methylthio)-
RN: 69482-98-0
InChIKey: NWTTWOYCQUPIDT-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H21-N3-O4-S

Molecular Weight

  • 399.4689
 
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Names and Synonyms

Synonyms

  • 1,2,4-Triazine, 5,6-bis(3,4-dimethoxyphenyl)-3-(methylthio)-
  • 5,6-Bis(3,4-dimethoxyphenyl)-3-(methylthio)-as-triazine
  • 5-26-03-00616 (Beilstein Handbook Reference)
  • BRN 0711464

Systematic Name

  • as-Triazine, 5,6-bis(3,4-dimethoxyphenyl)-3-(methylthio)-

Registry Numbers

CAS Registry Number

  • 69482-98-0

System Generated Number

  • 0069482980

Structure Descriptors

InChI

1S/C20H21N3O4S/c1-24-14-8-6-12(10-16(14)26-3)18-19(22-23-20(21-18)28-5)13-7-9-15(25-2)17(11-13)27-4/h6-11H,1-5H3

InChIKey

NWTTWOYCQUPIDT-UHFFFAOYSA-N

Smiles

COc1ccc(cc1OC)c2c(nnc(n2)SC)c3ccc(c(c3)OC)OC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 300mg/kg (300mg/kg)   Journal of Pharmaceutical Sciences. Vol. 69, Pg. 282, 1980.