Structure Information
Structure

Compound Identification

SMILES

CCOC(=O)C1=CC(Br)=C(NC(=O)CSC2=NC3=C(N=CC=C3)N2C2=C(C)C=C(C)C=C2C)C=C1

InChIKey

InChIKey=RZLLJAIVIOOOET-UHFFFAOYSA-N

Formula

C26H25BrN4O3S

Mass

553.48

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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 heteropolycyclic compounds

Substituents

Acylaminobenzoic acid or derivatives - 1-phenylimidazole - Benzoate ester - 3-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Imidazopyridine - Anilide - Aryl thioether - Benzoyl - N-arylamide - Halobenzene - Bromobenzene - Alkylarylthioether - N-substituted imidazole - Aryl bromide - Aryl halide - Pyridine - Imidazole - Azole - Heteroaromatic compound - Secondary carboxylic acid amide - Carboxylic acid ester - Carboxamide group - Azacycle - Organoheterocyclic compound - Sulfenyl compound - Carboxylic acid derivative - Thioether - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organobromide - Organohalogen compound - Aromatic heteropolycyclic 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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