Structure Information
Structure

Compound Identification

SMILES

CCCCOC(=O)C1=CC=C(NC(=S)NC(NC(=O)C2=CC=C(Cl)C=C2)C(Cl)(Cl)Cl)C=C1

InChIKey

InChIKey=JXNCHEMLMYXMPF-UHFFFAOYSA-N

Formula

C21H21Cl4N3O3S

Mass

537.28

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

Benzoic acid esters

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

Benzoate ester - N-phenylthiourea - 4-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzamide - Benzoyl - Chlorobenzene - Halobenzene - Aryl halide - Aryl chloride - Thiourea - Secondary carboxylic acid amide - Carboxamide group - Carboxylic acid ester - Carboxylic acid derivative - Organic nitrogen compound - Alkyl halide - Organosulfur compound - Organohalogen compound - Alkyl chloride - Organochloride - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organic oxygen compound - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as benzoic acid esters. These are ester derivatives of benzoic acid.

External Descriptors

Not available

Previous Back Next