Structure Information
Structure

Compound Identification

SMILES

CCOC(=O)C1=C(C)N(C2=C1C(CSC1=CC=CC=C1)=C(O)C=C2)C1=CC(Cl)=CC=C1

InChIKey

InChIKey=PLDWHIXSECCJKG-UHFFFAOYSA-N

Formula

C25H22ClNO3S

Mass

451.97

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Indoles and derivatives

Subclass

Indolecarboxylic acids and derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Indolecarboxylic acids and derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Indolecarboxylic acid derivative - 1-phenylpyrrole - Hydroxyindole - Indole - Aryl thioether - Pyrrole-3-carboxylic acid or derivatives - Thiophenol ether - Chlorobenzene - Halobenzene - 1-hydroxy-2-unsubstituted benzenoid - Alkylarylthioether - Phenol - Monocyclic benzene moiety - Benzenoid - Aryl chloride - Substituted pyrrole - Aryl halide - Pyrrole - Heteroaromatic compound - Vinylogous amide - Carboxylic acid ester - Thioether - Azacycle - Carboxylic acid derivative - Sulfenyl compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Organic nitrogen compound - Organic oxide - Organic oxygen compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as indolecarboxylic acids and derivatives. These are compounds containing a carboxylic acid group (or a derivative thereof) linked to an indole.

External Descriptors

Not available

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