Structure Information
Structure

Compound Identification

SMILES

COC1=C([O-])C=CC(=C1)C(C)=NNC(=O)C[NH+]1CCN(CC1)S(=O)(=O)C1=CC=C(C)C=C1

InChIKey

InChIKey=WVTGQVWYFSCIQK-UHFFFAOYSA-N

Formula

C22H28N4O5S

Mass

460.55

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Toluenes

Intermediate Tree Nodes

Tosyl compounds - P-toluenesulfonamides

Direct Parent

N,N-disubstituted p-toluenesulfonamides

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

N,n-disubstituted p-toluenesulfonamide - Alpha-amino acid or derivatives - Benzenesulfonamide - N-piperazineacetamide - Benzenesulfonyl group - Phenoxy compound - Anisole - Methoxybenzene - Phenol ether - Alkyl aryl ether - Phenoxide - N-alkylpiperazine - 1,4-diazinane - Piperazine - Organosulfonic acid amide - Quaternary ammonium salt - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Sulfonyl - Amino acid or derivatives - Tertiary aliphatic amine - Tertiary amine - Carboxylic acid derivative - Azacycle - Ether - Organoheterocyclic compound - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic salt - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Amine - Organic zwitterion - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as n,n-disubstituted p-toluenesulfonamides. These are p-toluenesulfonamide derivatives in which the sulfonamide moiety is N,N-disubstituted.

External Descriptors

Not available

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