Structure Information
Structure

Compound Identification

SMILES

CC(C)[C@H](N)C(=O)OCN1C=CSC1=NC(=O)C1=CC(Br)=C(NC(=O)CC(C)(C)C)C=C1

InChIKey

InChIKey=HHMMWELUERRIAA-SFHVURJKSA-N

Formula

C22H29BrN4O4S

Mass

525.46

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Benzoic acids and derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Acylaminobenzoic acid and derivatives

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Alpha-amino acid ester - Acylaminobenzoic acid or derivatives - Valine or derivatives - Alpha-amino acid or derivatives - Halobenzoic acid or derivatives - 3-halobenzoic acid or derivatives - Anilide - N-arylamide - Benzoyl - Fatty acid ester - Halobenzene - Bromobenzene - Aryl bromide - Fatty amide - Fatty acyl - Aryl halide - Heteroaromatic compound - Thiazole - Azole - Carboxamide group - Isothiourea - Amino acid or derivatives - Carboxylic acid ester - Secondary carboxylic acid amide - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Azacycle - Organic nitrogen compound - Primary aliphatic amine - Organohalogen compound - Carbonyl group - Organobromide - Organonitrogen compound - Organooxygen compound - Primary amine - Hydrocarbon derivative - Organic oxide - Amine - Organic oxygen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as acylaminobenzoic acid and derivatives. These are derivatives of amino benzoic acid derivatives where the amine group is N-acylated.

External Descriptors

Not available

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