Structure Information
Structure

Compound Identification

SMILES

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)OC1=CC=CC(C=C2SC(NC3=CC=C(Cl)C=C3)=NC2=O)=C1

InChIKey

InChIKey=ZOODMRAFZLGLTN-UHFFFAOYSA-N

Formula

C24H18ClN3O5S2

Mass

527.99

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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

Benzenesulfonate esters

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Benzenesulfonate ester - Acetanilide - Arylsulfonic acid or derivatives - N-acetylarylamine - Benzenesulfonyl group - Anilide - Phenoxy compound - N-arylamide - Aniline or substituted anilines - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Organosulfonic acid ester - Acetamide - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Meta-thiazoline - Sulfonyl - Carboxamide group - Isothiourea - Secondary carboxylic acid amide - N-acylimine - Organoheterocyclic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Azacycle - Carboxylic acid derivative - Hydrocarbon derivative - Organic nitrogen compound - Amine - Organic oxide - Carbonyl group - Organic oxygen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as benzenesulfonate esters. These are arenesulfonate esters that result from the formal condensation of the hydroxy group of an alcohol, enol, phenol or heteroarenol with benzenesulfonic acid.

External Descriptors

Not available

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