Structure Information
Structure

Compound Identification

SMILES

CC(CSC1=NC=CC=N1)NC(=O)C1=COC(CC(NCC2=CC=CC=C2)C(=O)OC2=C(F)C(F)=C(F)C(F)=C2F)=N1

InChIKey

InChIKey=ASKADKIPKKAOIT-UHFFFAOYSA-N

Formula

C27H22F5N5O4S

Mass

607.56

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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

Alpha amino acid esters

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Alpha-amino acid ester - Phenol ester - 2-heteroaryl carboxamide - Phenoxy compound - Aryl thioether - Phenylmethylamine - Benzylamine - 2,4-disubstituted 1,3-oxazole - Halobenzene - Fatty acid ester - Alkylarylthioether - Aralkylamine - Fluorobenzene - Fatty acyl - Benzenoid - Monocyclic benzene moiety - Aryl halide - Aryl fluoride - Pyrimidine - Azole - Heteroaromatic compound - Oxazole - Secondary carboxylic acid amide - Carboxamide group - Carboxylic acid ester - Secondary amine - Thioether - Oxacycle - Secondary aliphatic amine - Azacycle - Organoheterocyclic compound - Sulfenyl compound - Monocarboxylic acid or derivatives - Organooxygen compound - Organosulfur compound - Carbonyl group - Amine - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - Organic oxygen compound - Organohalogen compound - Organofluoride - Organonitrogen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as alpha amino acid esters. These are ester derivatives of alpha amino acids.

External Descriptors

Not available

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