Structure Information
Structure

Compound Identification

SMILES

NS(=O)(=O)C1=C(CC(=O)NCC(=O)N[C@@H]2CCCC[C@H]2N2CCCC2)C=CC(=C1)C(F)(F)F

InChIKey

InChIKey=ZFKOTRBMIDYSKT-IAGOWNOFSA-N

Formula

C21H29F3N4O4S

Mass

490.54

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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 heteromonocyclic compounds

Substituents

N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - Benzenesulfonamide - Trifluoromethylbenzene - Phenylacetamide - Benzenesulfonyl group - Cyclohexylamine - Monocyclic benzene moiety - Organosulfonic acid amide - N-alkylpyrrolidine - Benzenoid - Aminosulfonyl compound - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Pyrrolidine - Tertiary aliphatic amine - Tertiary amine - Secondary carboxylic acid amide - Carboxamide group - Organoheterocyclic compound - Azacycle - Alkyl halide - Organonitrogen compound - Organofluoride - Organohalogen compound - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Carbonyl group - Organic oxygen compound - Alkyl fluoride - Organosulfur compound - Organic nitrogen compound - Amine - Aromatic heteromonocyclic 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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