Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: 2-Pyrrolidinone, 3-((3-ethoxy-4-hydroxy-5-((phenylthio)methyl)phenyl)methylene)-
RN: 107788-14-7
InChIKey: JJABWYFSIMYYRT-XNTDXEJSSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H21-N-O3-S

Molecular Weight

  • 355.4559
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Synonym

  • 3-((3-Ethoxy-4-hydroxy-5-((phenylthio)methyl)phenyl)methylene)-2-pyrrolidinone

Systematic Name

  • 2-Pyrrolidinone, 3-((3-ethoxy-4-hydroxy-5-((phenylthio)methyl)phenyl)methylene)-

Registry Numbers

CAS Registry Number

  • 107788-14-7

System Generated Number

  • 0107788147

Structure Descriptors

InChI

1S/C20H21NO3S/c1-2-24-18-12-14(10-15-8-9-21-20(15)23)11-16(19(18)22)13-25-17-6-4-3-5-7-17/h3-7,10-12,22H,2,8-9,13H2,1H3,(H,21,23)/b15-10+

InChIKey

JJABWYFSIMYYRT-XNTDXEJSSA-N

Smiles

CCOc1cc(cc(c1O)CSc2ccccc2)/C=C/3\CCNC3=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 1gm/kg (1000mg/kg)   United States Patent Document. Vol. #4853403,