Structure Information
Structure

Compound Identification

SMILES

CCN1C(=S)SC(=CC2=CC(=C(OC)C=C2)S(O)(=O)=O)C1=O

InChIKey

InChIKey=RERKZBCPFASKEK-UHFFFAOYSA-N

Formula

C13H13NO5S3

Mass

359.43

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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 - 1-sulfo,2-unsubstituted aromatic compound - Benzenesulfonyl group - Arylsulfonic acid or derivatives - Phenol ether - Methoxybenzene - Anisole - Phenoxy compound - Alkyl aryl ether - Thiazolidinethione - Thiazolidine - Sulfonyl - Organic sulfonic acid or derivatives - Dithiocarbamic acid ester - Organosulfonic acid or derivatives - Organosulfonic acid - Cyclic dithiocarbamic acid ester - Carboxylic acid derivative - Ether - Azacycle - Organoheterocyclic compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Organosulfur compound - Hydrocarbon derivative - Organic oxide - 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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