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Substance Name: BRN 4263541
RN: 126335-04-4
InChIKey: RLNQCCVTUCBATR-BQYQJAHWSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C12-H12-N4-O2-S

Molecular Weight

  • 276.3188
 
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Names and Synonyms

Results Name

  • BRN 4263541

Synonyms

  • 4-Amino-3-methoxycarbonylvinylthio-5-phenyl-1,2,4-triazole
  • BRN 4263541
  • Methyl 3-((4-amino-5-phenyl-4H-1,2,4-triazol-3-yl)thio)-2-propenoate

Systematic Name

  • 2-Propenoic acid, 3-((4-amino-5-phenyl-4H-1,2,4-triazol-3-yl)thio)-, methyl ester

Registry Numbers

CAS Registry Number

  • 126335-04-4

System Generated Number

  • 0126335044

Structure Descriptors

InChI

1S/C12H12N4O2S/c1-18-10(17)7-8-19-12-15-14-11(16(12)13)9-5-3-2-4-6-9/h2-8H,13H2,1H3/b8-7+

InChIKey

RLNQCCVTUCBATR-BQYQJAHWSA-N

Smiles

COC(=O)/C=C/Sc1nnc(n1N)c2ccccc2

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mammal (species unspecified) LD50 unreported 550mg/kg (550mg/kg)   Pharmaceutical Chemistry Journal Vol. 23, Pg. 911, 1989.