Structure Information
Structure

Compound Identification

SMILES

COC1=CC=C(CC(=O)NCC2=NN=C(SCC(=O)NC3=C(Cl)C=CC(=C3)C(O)=O)N2C)C=C1

InChIKey

InChIKey=RMKFKYALONYXOD-UHFFFAOYSA-N

Formula

C22H22ClN5O5S

Mass

503.96

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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

Acylaminobenzoic acid or derivatives - 4-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - 4-halobenzoic acid - Halobenzoic acid - Phenylacetamide - Anilide - Benzoic acid - Phenol ether - Phenoxy compound - Aryl thioether - Anisole - Methoxybenzene - Benzoyl - N-arylamide - Halobenzene - Chlorobenzene - Alkyl aryl ether - Alkylarylthioether - Aryl chloride - Aryl halide - 1,2,4-triazole - Heteroaromatic compound - Azole - Carboxamide group - Secondary carboxylic acid amide - Azacycle - Organoheterocyclic compound - Sulfenyl compound - Thioether - Carboxylic acid derivative - Carboxylic acid - Ether - Hydrocarbon derivative - Organic oxide - Carbonyl group - Organic nitrogen compound - Organosulfur compound - Organic oxygen compound - Organooxygen compound - Organohalogen compound - Organochloride - Organonitrogen 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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