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Substance Name: Pyrimido(4,5-e)-as-triazine-3-acetic acid, 5,6,7,8-tetrahydro-alpha-cyano-6,8-dioxo-, ethyl ester
RN: 80761-67-7
InChIKey: QHGNJLJFLSMZMG-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C10-H8-N6-O4

Molecular Weight

  • 276.2112
 
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Names and Synonyms

Synonym

  • BRN 5119840

Systematic Name

  • Pyrimido(4,5-e)-as-triazine-3-acetic acid, 5,6,7,8-tetrahydro-alpha-cyano-6,8-dioxo-, ethyl ester

Registry Numbers

CAS Registry Number

  • 80761-67-7

System Generated Number

  • 0080761677

Structure Descriptors

InChI

1S/C10H8N6O4/c1-2-20-9(18)4(3-11)6-12-7-5(15-16-6)8(17)14-10(19)13-7/h4H,2H2,1H3,(H2,12,13,14,16,17,19)

InChIKey

QHGNJLJFLSMZMG-UHFFFAOYSA-N

Smiles

CCOC(=O)C(C#N)c1[nH]nc-2c(=O)[nH]c(=O)nc2n1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mammal (species unspecified) LD50 unreported 200mg/kg (200mg/kg)   Pharmaceutical Chemistry Journal Vol. 15, Pg. 789, 1981.