Structure Information
Structure

Compound Identification

SMILES

O=C(C1C(=O)N(C2=C1C=C(C=C2)C1=CC=CO1)C1=CN=CN=C1)C1=CC=CS1

InChIKey

InChIKey=HGAWYOAQSJWORM-UHFFFAOYSA-N

Formula

C21H13N3O3S

Mass

387.41

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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 - Aryl ketone - Aryl alkyl ketone - Pyrimidine - 1,3-dicarbonyl compound - Benzenoid - Furan - Tertiary carboxylic acid amide - Thiophene - Heteroaromatic compound - Carboxamide group - Ketone - Lactam - Tertiary amine - Amino acid or derivatives - Oxacycle - Carboxylic acid derivative - Azacycle - Organooxygen compound - Organonitrogen compound - Carbonyl group - Organic nitrogen compound - Amine - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - 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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