Structure Information
Structure

Compound Identification

SMILES

NC(=O)CNC(=O)C1=CC=CC=C1SC(=O)C1=C(C=CC=C1F)C(F)(F)F

InChIKey

InChIKey=PKOZVWYCNKAXMH-UHFFFAOYSA-N

Formula

C17H12F4N2O3S

Mass

400.35

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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

Benzamides

Direct Parent

Hippuric acids and derivatives

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

Hippuric acid or derivatives - N-acyl-alpha amino acid or derivatives - N-substituted-alpha-amino acid - Alpha-amino acid or derivatives - Trifluoromethylbenzene - Halobenzoic acid or derivatives - 2-halobenzoic acid or derivatives - O-sulfanylbenzoic acid or derivatives - Thiobenzoic acid or derivatives - Aryl thioether - Benzoyl - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - Vinylogous halide - Carbothioic s-ester - Carboxamide group - Thiocarboxylic acid ester - Secondary carboxylic acid amide - Primary carboxylic acid amide - Thiocarboxylic acid or derivatives - Sulfenyl compound - Carboxylic acid derivative - Organic oxygen compound - Organic nitrogen compound - Alkyl halide - Carbonyl group - Alkyl fluoride - Hydrocarbon derivative - Organic oxide - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as hippuric acids and derivatives. These are compounds containing a hippuric acid or a derivative, with a structure characterized the presence of a benzoyl group linked to the N-terminal of a glycine.

External Descriptors

Not available

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