Structure Information
Structure

Compound Identification

SMILES

CC(C)[C@H](NC(=O)C1=CC=C(F)C=C1)C(=O)N1CCN(CC1)S(=O)(=O)C1=CC=C(C=C1)C#N

InChIKey

InChIKey=IPGNWVMFGWJGEN-NRFANRHFSA-N

Formula

C23H25FN4O4S

Mass

472.54

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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 - Valine or derivatives - Alpha-amino acid amide - Alpha-amino acid or derivatives - 4-halobenzoic acid or derivatives - Benzenesulfonamide - Halobenzoic acid or derivatives - Benzenesulfonyl group - Benzonitrile - Benzoyl - Fluorobenzene - Halobenzene - Aryl fluoride - 1,4-diazinane - Organosulfonic acid amide - Piperazine - Aryl halide - Tertiary carboxylic acid amide - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Amino acid or derivatives - Carboxamide group - Tertiary amine - Secondary carboxylic acid amide - Nitrile - Carbonitrile - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Organofluoride - Amine - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Organosulfur compound - Hydrocarbon derivative - Organic oxide - Cyanide - Organooxygen compound - Organonitrogen compound - 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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