Structure Information
Structure

Compound Identification

SMILES

OC(=O)CC(O)(CC(O)=O)C(O)=O.ClC1=C(NC2=NCCN2)C2=NSN=C2C=C1

InChIKey

InChIKey=RJXGQQXNFPLDRB-UHFFFAOYSA-N

Formula

C15H16ClN5O7S

Mass

445.83

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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

Not available

Substituents

2,1,3-benzothiadiazole - Tricarboxylic acid or derivatives - Alpha-hydroxy acid - Aryl chloride - Aryl halide - Hydroxy acid - Benzenoid - Heteroaromatic compound - Azole - 2-imidazoline - Tertiary alcohol - Thiadiazole - Guanidine - Propargyl-type 1,3-dipolar organic compound - Carboximidamide - Organic 1,3-dipolar compound - Carboxylic acid derivative - Carboxylic acid - Azacycle - Amine - Alcohol - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen 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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