Structure Information
Structure

Compound Identification

SMILES

CCC(=O)NC1=CC=C(C=C1)C(=O)NNC(=S)NC(=O)COC1=C(Br)C=C(CC)C=C1

InChIKey

InChIKey=MPXXSSQUDNZXGV-UHFFFAOYSA-N

Formula

C21H23BrN4O4S

Mass

507.4

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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 homomonocyclic compounds

Substituents

Acylaminobenzoic acid or derivatives - Anilide - Phenoxy compound - Benzoyl - N-arylamide - Phenol ether - Alkyl aryl ether - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Thiosemicarbazide - Secondary carboxylic acid amide - Carboxamide group - Carboxylic acid hydrazide - Ether - Carboxylic acid derivative - Organohalogen compound - Organosulfur compound - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organobromide - Organonitrogen compound - Organooxygen compound - Aromatic homomonocyclic 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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