Structure Information
Structure

Compound Identification

SMILES

CC1=C(C=C(N1CC1CCCCC1)C1=CSC(=N1)C1=CC=CC=C1F)C(O)=O

InChIKey

InChIKey=NCVCTJMKRRXJQA-UHFFFAOYSA-N

Formula

C22H23FN2O2S

Mass

398.5

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Pyrroles

Subclass

Pyrrole carboxylic acids and derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Pyrrole carboxylic acids

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Pyrrole-3-carboxylic acid - 2,4-disubstituted 1,3-thiazole - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Substituted pyrrole - Azole - Heteroaromatic compound - Vinylogous amide - Thiazole - Azacycle - Carboxylic acid derivative - Carboxylic acid - Organooxygen compound - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organohalogen compound - Organofluoride - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as pyrrole carboxylic acids. These are heterocyclic compounds containing a pyrrole ring bearing a carboxyl group.

External Descriptors

Not available

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