Structure Information
Structure

Compound Identification

SMILES

NCCCNCCCCNCCCNC(=O)CCCCCNS(=O)(=O)C1=CC=C(CNC(=O)C2=CC=C(Cl)C=C2)S1

InChIKey

InChIKey=PFSCEFUZMKLDLV-UHFFFAOYSA-N

Formula

C28H45ClN6O4S2

Mass

629.28

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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 - Halobenzene - 2,5-disubstituted thiophene - Chlorobenzene - N-acyl-amine - Aryl chloride - Aryl halide - Fatty acyl - Fatty amide - Organosulfonic acid amide - Heteroaromatic compound - Aminosulfonyl compound - Thiophene - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Amino acid or derivatives - Carboxamide group - Secondary carboxylic acid amide - Organoheterocyclic compound - Secondary amine - Carboxylic acid derivative - Secondary aliphatic amine - Organooxygen compound - Organosulfur compound - Organic oxygen compound - Primary amine - Organic nitrogen compound - Carbonyl group - Amine - Hydrocarbon derivative - Organic oxide - Primary aliphatic amine - Organonitrogen compound - 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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