Structure Information
Structure

Compound Identification

SMILES

CC1=C(OCC(=O)NC(=S)NC2=C(Br)C=C(Br)C=C2C(O)=O)C=CC(Cl)=C1

InChIKey

InChIKey=PZYQPBBLUZLDBI-UHFFFAOYSA-N

Formula

C17H13Br2ClN2O4S

Mass

536.62

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

N-phenylthioureas

Intermediate Tree Nodes

Not available

Direct Parent

N-acyl-phenylthioureas

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

N-acyl-phenylthiourea - Halobenzoic acid - 3-halobenzoic acid - Halobenzoic acid or derivatives - 3-halobenzoic acid or derivatives - Benzoic acid or derivatives - Benzoic acid - Phenoxy compound - Benzoyl - Phenol ether - Alkyl aryl ether - Bromobenzene - Chlorobenzene - Halobenzene - Toluene - Aryl halide - Aryl chloride - Aryl bromide - Vinylogous amide - Thiourea - Carboxylic acid derivative - Carboxylic acid - Ether - Organonitrogen compound - Hydrocarbon derivative - Organohalogen compound - Carbonyl group - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Organosulfur compound - Organobromide - Organochloride - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as n-acyl-phenylthioureas. These are thiourea derivatives where one nitrogen atom of the urea group is linked to a phenyl group and the other is acylated.

External Descriptors

Not available

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