Structure Information
Structure

Compound Identification

SMILES

CC1=CC=C(C=C1)S(=O)(=O)N1C[C@@H](C[C@H]1C(=O)N[C@@H](CC1=CC=CC=C1)C=O)C#N

InChIKey

InChIKey=XVWXCCZGFARKAQ-ZJOUEHCJSA-N

Formula

C22H23N3O4S

Mass

425.5

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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 - Proline or derivatives - Alpha-amino acid amide - Alpha-amino acid or derivatives - Amphetamine or derivatives - Benzenesulfonamide - Benzenesulfonyl group - Pyrrolidine carboxylic acid or derivatives - Pyrrolidine-2-carboxamide - Organosulfonic acid amide - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Pyrrolidine - Carboxamide group - Secondary carboxylic acid amide - Carboxylic acid derivative - Carbonitrile - Nitrile - Azacycle - Organoheterocyclic compound - Organic oxygen compound - Organic nitrogen compound - Aldehyde - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Cyanide - 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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