Structure Information
Structure

Compound Identification

SMILES

CCOC(=O)C(SC(=S)NN1C=NN=C1)C(C)=O

InChIKey

InChIKey=HBNRVOATGZZCNJ-UHFFFAOYSA-N

Formula

C9H12N4O3S2

Mass

288.34

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic acids and derivatives

Class

Keto acids and derivatives

Subclass

Beta-keto acids and derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Beta-keto acids and derivatives

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Beta-keto acid - Fatty acid ester - 1,3-dicarbonyl compound - Fatty acyl - Azole - 1,2,4-triazole - Heteroaromatic compound - Carboxylic acid ester - Ketone - Sulfenyl compound - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Azacycle - Organoheterocyclic compound - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Organic oxide - Carbonyl group - Organic oxygen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as beta-keto acids and derivatives. These are organic compounds containing an aldehyde substituted with a keto group on the C3 carbon atom.

External Descriptors

Not available

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