Structure Information
Structure

Compound Identification

SMILES

CS(=O)(=O)NC1=CC=CC=C1N1CCN(CC1)C(=O)[C@@H](CC1=CC=C(Cl)C=C1)NC(=O)C1=CC2=C(OCO2)C=C1

InChIKey

InChIKey=JLIHMDKDIYKBML-HSZRJFAPSA-N

Formula

C28H29ClN4O6S

Mass

585.07

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic acids and derivatives

Class

Carboxylic acids and derivatives

Subclass

Amino acids, peptides, and analogues

Intermediate Tree Nodes

Amino acids and derivatives - Alpha amino acids and derivatives

Direct Parent

N-acyl-alpha amino acids and derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - Phenylpiperazine - N-arylpiperazine - Amphetamine or derivatives - Sulfanilide - Benzodioxole - Tertiary aliphatic/aromatic amine - Aniline or substituted anilines - Dialkylarylamine - Chlorobenzene - Halobenzene - 1,4-diazinane - Monocyclic benzene moiety - Aryl halide - Aryl chloride - Benzenoid - Organosulfonic acid amide - Piperazine - Organic sulfonic acid amide - Aminosulfonyl compound - Tertiary carboxylic acid amide - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Carboxamide group - Secondary carboxylic acid amide - Tertiary amine - Organoheterocyclic compound - Azacycle - Acetal - Oxacycle - Hydrocarbon derivative - Organic nitrogen compound - Organic oxide - Organohalogen compound - Carbonyl group - Organopnictogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Amine - Organosulfur compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as n-acyl-alpha amino acids and derivatives. These are compounds containing an alpha amino acid (or a derivative thereof) which bears an acyl group at its terminal nitrogen atom.

External Descriptors

Not available

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