Structure Information
Structure

Compound Identification

SMILES

CCN1C(=O)CC(SC1=NC1=CC=C(I)C=C1)C(=O)NC1=CC=C(C=C1)C(=O)OC

InChIKey

InChIKey=KPPFABSJSHFRJB-UHFFFAOYSA-N

Formula

C21H20IN3O4S

Mass

537.37

Export to:

JSON SDF CSV

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 - Benzoate ester - Anilide - Benzoyl - N-arylamide - Halobenzene - Iodobenzene - Aryl halide - Aryl iodide - 1,3-thiazinane - Methyl ester - Carboxamide group - Carboxylic acid ester - Isothiourea - Secondary carboxylic acid amide - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organoheterocyclic compound - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Azacycle - Organooxygen compound - Organic oxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Organohalogen compound - Carbonyl group - Organic oxide - Organopnictogen compound - Organoiodide - 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

Previous Back Next