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Substance Name: 4H-1-Benzopyran-2-carbonitrile, 4-thioxo-
RN: 38243-69-5
InChIKey: NVOWEWSIFTXYAN-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C10-H5-N-O-S

Molecular Weight

  • 187.2215
 
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Names and Synonyms

Synonyms

  • 4-Thioxo-4H-1-benzopyran-2-carbonitrile
  • 5-18-08-00320 (Beilstein Handbook Reference)
  • BRN 1367549

Systematic Name

  • 4H-1-Benzopyran-2-carbonitrile, 4-thioxo-

Registry Numbers

CAS Registry Number

  • 38243-69-5

System Generated Number

  • 0038243695

Structure Descriptors

InChI

1S/C10H5NOS/c11-6-7-5-10(13)8-3-1-2-4-9(8)12-7/h1-5H

InChIKey

NVOWEWSIFTXYAN-UHFFFAOYSA-N

Smiles

c1ccc2c(c1)c(=S)cc(o2)C#N

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 100mg/kg (100mg/kg)   Journal of Medicinal Chemistry. Vol. 15, Pg. 865, 1972.