Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Thiocyanic acid, 1,3-dimethyl-5-ethyl-2,4,6-trioxohexahydro-5-pyrimidinyl ester
RN: 10038-06-9
InChIKey: WPZVCWYNTRLWHL-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C9-H11-N3-O3-S

Molecular Weight

  • 241.27
 
* 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

  • 1,3-Dimethyl-5-aethyl-5-thiocyanbarbitursaeure
  • 1,3-Dimethyl-5-aethyl-5-thiocyanbarbitursaeure [German]
  • 5-25-03-00278 (Beilstein Handbook Reference)
  • Barbituric acid, 1,3-dimethyl-5-ethyl-5-thiocyano-
  • BRN 0669131

Systematic Name

  • Thiocyanic acid, 1,3-dimethyl-5-ethyl-2,4,6-trioxohexahydro-5-pyrimidinyl ester

Registry Numbers

CAS Registry Number

  • 10038-06-9

System Generated Number

  • 0010038069

Structure Descriptors

InChI

1S/C9H11N3O3S/c1-4-9(16-5-10)6(13)11(2)8(15)12(3)7(9)14/h4H2,1-3H3

InChIKey

WPZVCWYNTRLWHL-UHFFFAOYSA-N

Smiles

S(C#N)C1(C(N(C(N(C1=O)C)=O)C)=O)CC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 90mg/kg (90mg/kg)   Archiv der Pharmazie und Berichte der Deutschen Pharmazeutischen Gesellschaft. Vol. 302, Pg. 297, 1969.