Structure Information
Structure

Compound Identification

SMILES

CC1=CC(=C(NC2=NN=C(CSC3=CC=C(Cl)C=C3)S2)C=C1)S(O)(=O)=O

InChIKey

InChIKey=LFAIDABUOLWUEQ-UHFFFAOYSA-N

Formula

C16H14ClN3O3S3

Mass

427.94

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Benzenesulfonic acids and derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Benzenesulfonic acids and derivatives

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Benzenesulfonate - Benzenesulfonyl group - Arylsulfonic acid or derivatives - 1-sulfo,2-unsubstituted aromatic compound - Aryl thioether - Aniline or substituted anilines - Thiophenol ether - Chlorobenzene - Halobenzene - 2-amino-5-substituted-1,3,4-thiadiazole - Toluene - Alkylarylthioether - 2-amino-1,3,4-thiadiazole - Aryl chloride - Aryl halide - Azole - Heteroaromatic compound - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Organosulfonic acid - Sulfonyl - Thiadiazole - Secondary amine - Azacycle - Thioether - Organoheterocyclic compound - Sulfenyl compound - Organosulfur compound - Organonitrogen compound - Organochloride - Organohalogen compound - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Amine - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as benzenesulfonic acids and derivatives. These are organic compounds containing a sulfonic acid or a derivative thereof that is linked to a benzene ring.

External Descriptors

Not available

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