Structure Information
Structure

Compound Identification

SMILES

OC(=O)CNC(=O)CSC1=C(C#N)C(=CC(=N1)C1=CC=CS1)C1=CC=C(F)C=C1

InChIKey

InChIKey=JARLZQQNQKOMSB-UHFFFAOYSA-N

Formula

C20H14FN3O3S2

Mass

427.47

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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 - N-acyl-alpha amino acids and derivatives

Direct Parent

N-acyl-alpha amino acids

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

N-acyl-alpha-amino acid - 4-phenylpyridine - Aryl thioether - 3-pyridinecarbonitrile - Fluorobenzene - Halobenzene - Alkylarylthioether - Aryl halide - Monocyclic benzene moiety - Pyridine - Benzenoid - Aryl fluoride - Heteroaromatic compound - Thiophene - Carboxamide group - Secondary carboxylic acid amide - Azacycle - Organoheterocyclic compound - Sulfenyl compound - Thioether - Carboxylic acid - Monocarboxylic acid or derivatives - Carbonitrile - Nitrile - Cyanide - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic oxygen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as n-acyl-alpha amino acids. These are compounds containing an alpha amino acid which bears an acyl group at its terminal nitrogen atom.

External Descriptors

Not available

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