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Substance Name: 2-Propen-1-one, 1-phenyl-3-(2-phenyl-5-(phenylamino)-1,3,4-thiadiazol-3(2H)-yl)-
RN: 125791-41-5
InChIKey: GEHMDTFXHNHHHQ-WUKNDPDISA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C23-H19-N3-O-S

Molecular Weight

  • 385.4891
 
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Names and Synonyms

Synonyms

  • 1-Phenyl-3-(2-phenyl-5-(phenylamino)-1,3,4-thiadiazol-3(2H)-yl)-2-propen-1-one
  • BRN 4238040

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 125791-41-5

System Generated Number

  • 0125791415

Structure Descriptors

InChI

1S/C23H19N3OS/c27-21(18-10-4-1-5-11-18)16-17-26-22(19-12-6-2-7-13-19)28-23(25-26)24-20-14-8-3-9-15-20/h1-17,22H,(H,24,25)/b17-16+

InChIKey

GEHMDTFXHNHHHQ-WUKNDPDISA-N

Smiles

c1ccc(cc1)C2N(N=C(S2)Nc3ccccc3)/C=C/C(=O)c4ccccc4

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mammal (species unspecified) LD50 unreported 600mg/kg (600mg/kg)   Pharmaceutical Chemistry Journal Vol. 23, Pg. 1008, 1989.