Structure Information
Structure

Compound Identification

SMILES

CCOC(=O)C1=C(C)C(C(=O)OCC)=C(NC(=O)C2=C(Cl)C3=NC(CC(N3N2)C(F)(F)F)C2=CC=C(Br)C=C2)S1

InChIKey

InChIKey=UZDOFZOGQRUJCC-UHFFFAOYSA-N

Formula

C25H23BrClF3N4O5S

Mass

663.89

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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 - Thiophene carboxylic acid or derivatives - N-arylamide - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Hydropyrimidine - 1,4,5,6-tetrahydropyrimidine - Pyrimidine - Imidolactam - Benzenoid - Pyrazoline - Pyrazole - Vinylogous halide - Vinylogous amide - Thiophene - Heteroaromatic compound - Carboxylic acid amidrazone - Carboxamide group - Carboxylic acid ester - Secondary carboxylic acid amide - Organic 1,3-dipolar compound - Amidine - Vinyl chloride - Vinyl halide - Propargyl-type 1,3-dipolar organic compound - Azacycle - Chloroalkene - Organoheterocyclic compound - Haloalkene - Organooxygen compound - Organohalogen compound - Organic nitrogen compound - Alkyl halide - Carbonyl group - Organobromide - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Alkyl fluoride - Organochloride - Organofluoride - Organonitrogen 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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