Structure Information
Structure

Compound Identification

SMILES

CNC1=C(C=C(OC(F)(F)F)C=C1)C(=O)NCC(=O)N[C@H]1C[C@@H](CC[C@H]1CS(=O)(=O)C1=CC=C(SC)C=C1)N(C)C

InChIKey

InChIKey=SBESLHWBNLDWTH-RHGYRFJNSA-N

Formula

C27H35F3N4O5S2

Mass

616.72

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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

N-acyl-alpha amino acid or derivatives - Hippuric acid or derivatives - Alpha-amino acid amide - Anthranilamide - N-substituted-alpha-amino acid - Alpha-amino acid or derivatives - 2-aminobenzamide - Aminobenzamide - Aminobenzoic acid or derivatives - Benzenesulfonyl group - Phenylalkylamine - Aniline or substituted anilines - Thiophenol ether - Aryl thioether - Phenoxy compound - Phenol ether - Benzoyl - Secondary aliphatic/aromatic amine - Alkylarylthioether - Cyclohexylamine - Vinylogous amide - Sulfonyl - Sulfone - Amino acid or derivatives - Trihalomethane - Carboxamide group - Tertiary aliphatic amine - Tertiary amine - Secondary carboxylic acid amide - Secondary amine - Carboxylic acid derivative - Thioether - Sulfenyl compound - Organofluoride - Organic oxygen compound - Organohalogen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Halomethane - Alkyl halide - Alkyl fluoride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic oxide - Amine - 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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