Structure Information
Structure

Compound Identification

SMILES

CCC(C)C(NS(=O)(=O)C1=C(Cl)C=CC(Cl)=C1)C(=O)NC1=NN=C(S1)C1=CC(C)=CC=C1

InChIKey

InChIKey=WUQMECALAFIMRH-UHFFFAOYSA-N

Formula

C21H22Cl2N4O3S2

Mass

513.45

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic acids and derivatives

Class

Carboxylic acids and derivatives

Subclass

Amino acids, peptides, and analogues

Intermediate Tree Nodes

Amino acids and derivatives - Alpha amino acids and derivatives

Direct Parent

Isoleucine and derivatives

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Isoleucine or derivatives - Alpha-amino acid amide - Benzenesulfonamide - Benzenesulfonyl group - 1,4-dichlorobenzene - N-arylamide - Chlorobenzene - Toluene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Fatty acyl - Benzenoid - Fatty amide - Organosulfonic acid amide - Azole - Heteroaromatic compound - Aminosulfonyl compound - Thiadiazole - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Sulfonyl - Carboxamide group - Secondary carboxylic acid amide - Organoheterocyclic compound - Azacycle - Organochloride - Organohalogen compound - Organic oxide - Organic oxygen compound - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic nitrogen compound - Hydrocarbon derivative - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as isoleucine and derivatives. These are compounds containing isoleucine or a derivative thereof resulting from reaction of isoleucine at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.

External Descriptors

Not available

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