Structure Information
Structure

Compound Identification

SMILES

C[C@H](O)C1=CC(NC(=O)C2=C(Cl)C3=N[C@@H](C[C@H](N3N2)C(F)(F)F)C2=CC=CS2)=CC=C1

InChIKey

InChIKey=ACGYFWFKCYNEOS-XEGUGMAKSA-N

Formula

C20H18ClF3N4O2S

Mass

470.9

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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

Direct Parent

Alpha amino acids and derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Alpha-amino acid or derivatives - Pyrazolopyrimidine - Pyrimidinecarboxamide - Anilide - N-arylamide - Monocyclic benzene moiety - Hydropyrimidine - 1,4,5,6-tetrahydropyrimidine - Pyrimidine - Benzenoid - Imidolactam - Pyrazole - Pyrazoline - Heteroaromatic compound - Thiophene - Vinylogous halide - Secondary carboxylic acid amide - Secondary alcohol - Carboxylic acid amidrazone - Carboxamide group - Amidine - Vinyl halide - Vinyl chloride - Organic 1,3-dipolar compound - Chloroalkene - Azacycle - Propargyl-type 1,3-dipolar organic compound - Organoheterocyclic compound - Haloalkene - Aromatic alcohol - Organofluoride - Organochloride - Organohalogen compound - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Carbonyl group - Organic oxygen compound - Organooxygen compound - Alcohol - Alkyl fluoride - Alkyl halide - Organic nitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as alpha amino acids and derivatives. These are amino acids in which the amino group is attached to the carbon atom immediately adjacent to the carboxylate group (alpha carbon), or a derivative thereof.

External Descriptors

Not available

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