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Structure Information
Structure

Compound Identification

SMILES

CC1=CC(C(=O)C(O)=O)=C(C)N1C1=CC2=C(SN=N2)C=C1

InChIKey

InChIKey=XLBZPCCAZQOLIK-UHFFFAOYSA-N

Formula

C14H11N3O3S

Mass

301.32

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Benzothiadiazoles

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Benzothiadiazoles

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

1,2,3-benzothiadiazole - Aryl ketone - Alpha-keto acid - Keto acid - Benzenoid - Substituted pyrrole - Alpha-hydroxy ketone - Azole - Heteroaromatic compound - Vinylogous amide - Thiadiazole - Pyrrole - Ketone - Carboxylic acid derivative - Carboxylic acid - Azacycle - Monocarboxylic acid or derivatives - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organooxygen compound - Organic oxide - Organonitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as benzothiadiazoles. These are heterocyclic aromatic compounds containing a benzene ring fused to a thiadiazole ring. Thiadiazole is a five-membered aromatic heterocycle made up of one sulfur atom and two nitrogen atoms.

External Descriptors

Not available

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