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Substance Name: 2-Propen-1-one, 3-(3-(phenylamino)-4-thia-1,2-diazaspiro(4,5)dec-2-en-1-yl)-1-(2-thienyl)-
RN: 125810-88-0
InChIKey: XRJOSNMOHNKPBU-SDNWHVSQSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H21-N3-O-S2

Molecular Weight

  • 383.5379
 
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Names and Synonyms

Synonyms

  • 3-(3-(Phenylamino)-4-thia-1,2-diazaspiro(4,5)dec-2-en-1-yl)-1-(2-thienyl)-2-propen-1-one
  • BRN 4238192

Systematic Name

  • 2-Propen-1-one, 3-(3-(phenylamino)-4-thia-1,2-diazaspiro(4,5)dec-2-en-1-yl)-1-(2-thienyl)-

Registry Numbers

CAS Registry Number

  • 125810-88-0

System Generated Number

  • 0125810880

Structure Descriptors

InChI

1S/C20H21N3OS2/c24-17(18-10-7-15-25-18)11-14-23-20(12-5-2-6-13-20)26-19(22-23)21-16-8-3-1-4-9-16/h1,3-4,7-11,14-15H,2,5-6,12-13H2,(H,21,22)/b14-11+

InChIKey

XRJOSNMOHNKPBU-SDNWHVSQSA-N

Smiles

c1ccc(cc1)NC2=NN(C3(S2)CCCCC3)/C=C/C(=O)c4cccs4

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.