Structure Information
Structure

Compound Identification

SMILES

COC(=O)C1=C(NC(=O)CS(=O)(=O)C2=NN=C(O2)C2=CC(C)=C(C)C=C2)SC2=C1CCC2

InChIKey

InChIKey=PLXPEQMHLQEVHG-UHFFFAOYSA-N

Formula

C21H21N3O6S2

Mass

475.53

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Thiophenes

Subclass

Thiophene carboxylic acids and derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Thiophene carboxylic acids and derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

O-xylene - Xylene - Thiophene carboxylic acid or derivatives - N-arylamide - Monocyclic benzene moiety - Benzenoid - 1,3,4-oxadiazole - Azole - Oxadiazole - Sulfone - Heteroaromatic compound - Sulfonyl - Vinylogous amide - Methyl ester - Carboxamide group - Carboxylic acid ester - Secondary carboxylic acid amide - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Oxacycle - Azacycle - Organic oxygen compound - Organic oxide - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Carbonyl group - Organopnictogen compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as thiophene carboxylic acids and derivatives. These are compounds containing a thiophene ring which bears a carboxylic acid group (or a salt/ester thereof).

External Descriptors

Not available

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