Structure Information
Structure

Compound Identification

SMILES

NC(=O)NC1=C(Cl)C=CC(CN2CC[C@H](C2)NC(=O)CNC(=O)C2=C(N)C=CC(=C2)C(F)(F)F)=C1

InChIKey

InChIKey=UJRWHQXUJHFCAG-CQSZACIVSA-N

Formula

C22H24ClF3N6O3

Mass

512.92

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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 heteromonocyclic compounds

Substituents

N-acyl-alpha amino acid or derivatives - Hippuric acid or derivatives - Alpha-amino acid amide - Anthranilamide - N-substituted-alpha-amino acid - Trifluoromethylbenzene - Alpha-amino acid or derivatives - Aminobenzamide - Aminobenzoic acid or derivatives - 2-aminobenzamide - N-phenylurea - Phenylmethylamine - Aniline or substituted anilines - Benzoyl - Benzylamine - Halobenzene - Chlorobenzene - Aralkylamine - Aryl chloride - Aryl halide - N-alkylpyrrolidine - Pyrrolidine - Vinylogous amide - Amino acid or derivatives - Carboxamide group - Urea - Tertiary aliphatic amine - Tertiary amine - Secondary carboxylic acid amide - Azacycle - Carboxylic acid derivative - Organoheterocyclic compound - Organochloride - Carbonyl group - Organofluoride - Organonitrogen compound - Alkyl halide - Alkyl fluoride - Organic nitrogen compound - Hydrocarbon derivative - Primary amine - Organooxygen compound - Organic oxygen compound - Organic oxide - Amine - Organohalogen compound - Aromatic heteromonocyclic 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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