Structure Information
Structure

Compound Identification

SMILES

ClC1=CC=C(C=C1)C(=O)NCC1=CC=C(S1)S(=O)(=O)NNC(=O)C1=CSC(=N1)C1=CC=C(C=C1)C1SCCS1

InChIKey

InChIKey=QGPMWNYJRIRPEZ-UHFFFAOYSA-N

Formula

C25H21ClN4O4S5

Mass

637.22

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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

4-halobenzoic acids and derivatives

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

4-halobenzoic acid or derivatives - Benzamide - Benzoyl - Thiazolecarboxamide - Thiazolecarboxylic acid or derivatives - 2,4-disubstituted 1,3-thiazole - Chlorobenzene - Halobenzene - 2,5-disubstituted thiophene - Aryl chloride - Aryl halide - Sulfonohydrazide - Hydrazinosulfonyl compound - Azole - Heteroaromatic compound - Thioacetal - Dithiolane - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Sulfonyl - 1,3-dithiolane - Thiophene - Thiazole - Carboxamide group - Secondary carboxylic acid amide - Thioether - Azacycle - Carboxylic acid derivative - Dialkylthioether - Organoheterocyclic compound - Organosulfur compound - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organooxygen compound - Organic oxygen compound - Organic oxide - Organohalogen compound - Organochloride - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as 4-halobenzoic acids and derivatives. These are benzoic acids or derivatives carrying a halogen atom at the 4-position of the benzene ring.

External Descriptors

Not available

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