Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: 1-Thiocoumarin, 3-nitro-4-anilino-
RN: 59647-32-4
InChIKey: LIBDTFQESDZGLE-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C15-H10-N2-O3-S

Molecular Weight

  • 298.321
 
* 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

Synonyms

  • 2H-1-Benzothiopyran-2-one, 3-nitro-4-(phenylamino)-
  • 3-Nitro-4-(phenylamino)-2H-1-benzothiopyran-2-one
  • 3-Nitro-4-anilino-1-thiocoumarin

Systematic Name

  • 1-Thiocoumarin, 3-nitro-4-anilino-

Registry Numbers

CAS Registry Number

  • 59647-32-4

System Generated Number

  • 0059647324

Structure Descriptors

InChI

1S/C15H10N2O3S/c18-15-14(17(19)20)13(16-10-6-2-1-3-7-10)11-8-4-5-9-12(11)21-15/h1-9,16H

InChIKey

LIBDTFQESDZGLE-UHFFFAOYSA-N

Smiles

c1ccc(cc1)Nc2c3ccccc3sc(=O)c2[N+](=O)[O-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 50mg/kg (50mg/kg) BEHAVIORAL: CHANGES IN MOTOR ACTIVITY (SPECIFIC ASSAY) Pharmaceutical Chemistry Journal Vol. 12, Pg. 1590, 1978.