Structure Information
Structure

Compound Identification

SMILES

CC1=CC(CSC2=NN=C(NC(=O)CSC3=NC4=C(S3)C=C(NC(=O)C3=CC=CC=C3Cl)C=C4)S2)=CC=C1

InChIKey

InChIKey=GLERSYALOFZOKS-UHFFFAOYSA-N

Formula

C26H20ClN5O2S4

Mass

598.17

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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

Halobenzoic acids and derivatives

Direct Parent

2-halobenzoic acids and derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

2-halobenzoic acid or derivatives - 1,3-benzothiazole - Benzamide - Benzoyl - N-arylamide - Aryl thioether - Alkylarylthioether - Chlorobenzene - Toluene - Halobenzene - Aryl chloride - Aryl halide - Azole - Thiazole - Heteroaromatic compound - Thiadiazole - Vinylogous halide - Carboxamide group - Secondary carboxylic acid amide - Thioether - Sulfenyl compound - Carboxylic acid derivative - Organoheterocyclic compound - Azacycle - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organosulfur compound - Organic nitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 2-halobenzoic acids and derivatives. These are benzoic acids or derivatives carrying a halogen atom at the 2-position of the benzene ring.

External Descriptors

Not available

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