Structure Information
Structure

Compound Identification

SMILES

CC(C)(C)SC1=C(N(CC2=CC=C(Cl)C=C2)C2=C1C=C(OCC=C)C=C2)C([O-])=O

InChIKey

InChIKey=XCJNPRSJDNTYKZ-UHFFFAOYSA-M

Formula

C23H23ClNO3S

Mass

428.95

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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 - N-alkylindole - Indole - Aryl thioether - Phenol ether - Pyrrole-2-carboxylic acid - Pyrrole-2-carboxylic acid or derivatives - Alkyl aryl ether - Chlorobenzene - Halobenzene - Alkylarylthioether - Substituted pyrrole - Vinylogous thioester - Aryl halide - Benzenoid - Monocyclic benzene moiety - Aryl chloride - Pyrrole - Heteroaromatic compound - Carboxylic acid salt - Azacycle - Sulfenyl compound - Thioether - Carboxylic acid derivative - Carboxylic acid - Ether - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Organic oxygen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic anion - 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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