Structure Information
Structure

Compound Identification

SMILES

CC1=CC(C)=NC(SCC2=CC=C(C=C2)C(=O)NNC=C2C=CC=C(O)C2=O)=N1

InChIKey

InChIKey=ICUUJCCUPXXXGD-UHFFFAOYSA-N

Formula

C21H20N4O3S

Mass

408.48

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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

Not available

Direct Parent

Benzoic acids and derivatives

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Benzoic acid or derivatives - Aryl thioether - Benzoyl - O-quinomethane - Quinomethane - Alkylarylthioether - Pyrimidine - Heteroaromatic compound - Vinylogous amide - Carboxylic acid hydrazide - Ketone - Cyclic ketone - Carboxylic acid derivative - Enol - Azacycle - Organoheterocyclic compound - Sulfenyl compound - Thioether - Organic oxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Carbonyl group - Organic oxide - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as benzoic acids and derivatives. These are organic compounds containing a carboxylic acid substituent attached to a benzene ring.

External Descriptors

Not available

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