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Substance Name: 2-Propen-1-one, 3-(5-amino-2-(2-thienyl)-1,3,4-thiadiazol-3(2H)-yl)-1-phenyl-
RN: 125810-86-8
InChIKey: SZJMMBQBSOMLQG-CMDGGOBGSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C15-H13-N3-O-S2

Molecular Weight

  • 315.4197
 
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Names and Synonyms

Synonyms

  • 5-Amino-3-benzoylvinyl-2-(2-thienyl)-delta(sup 4)-1,3,4-thiadiazoline
  • BRN 4236663

Systematic Name

  • 2-Propen-1-one, 3-(5-amino-2-(2-thienyl)-1,3,4-thiadiazol-3(2H)-yl)-1-phenyl-

Registry Numbers

CAS Registry Number

  • 125810-86-8

System Generated Number

  • 0125810868

Structure Descriptors

InChI

1S/C15H13N3OS2/c16-15-17-18(14(21-15)13-7-4-10-20-13)9-8-12(19)11-5-2-1-3-6-11/h1-10,14H,(H2,16,17)/b9-8+

InChIKey

SZJMMBQBSOMLQG-CMDGGOBGSA-N

Smiles

c1ccc(cc1)C(=O)/C=C/N2C(SC(=N2)N)c3cccs3

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mammal (species unspecified) LD50 unreported 240mg/kg (240mg/kg)   Pharmaceutical Chemistry Journal Vol. 23, Pg. 1008, 1989.