Structure Information
Structure

Compound Identification

SMILES

NC(N)=NC1=CC=C(C=C1)C(=O)N(CC1=CC2=CC=CC=C2O1)C1CCN(C1)S(=O)(=O)\C=C\C1=CC=C(Cl)C=C1

InChIKey

InChIKey=XXDZUBAHQJUCLK-JQIJEIRASA-N

Formula

C29H28ClN5O4S

Mass

578.08

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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

Aminobenzoic acids and derivatives

Direct Parent

Guanidinobenzoic acids and derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Guanidinobenzoic acid or derivatives - Benzamide - Benzofuran - Benzoyl - Styrene - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Organic sulfonic acid amide - Organosulfonic acid amide - Heteroaromatic compound - Furan - Pyrrolidine - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Tertiary carboxylic acid amide - Sulfonyl - Carboxamide group - Guanidine - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Carboxylic acid derivative - Oxacycle - Organoheterocyclic compound - Azacycle - Organosulfur compound - Organic nitrogen compound - Organohalogen compound - Organochloride - Organic oxygen compound - Organonitrogen compound - Organic oxide - Organooxygen compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as guanidinobenzoic acids and derivatives. These are aromatic compounds containing a guanidine group linked to the benzene ring of a benzoic acid (or a derivative thereof).

External Descriptors

Not available

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