Structure Information
Structure

Compound Identification

SMILES

COC1=CC(=C(NC2=CC(Cl)=C(CNC(=O)[C@@]3(CCOC3)NC(=O)C3=CN=CN=C3)N=C2)C=C1)C(F)(F)F

InChIKey

InChIKey=GNPYBWMAWFUGFX-QHCPKHFHSA-N

Formula

C24H22ClF3N6O4

Mass

550.92

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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 - Trifluoromethylbenzene - Aminophenyl ether - Pyrimidinecarboxamide - Pyrimidine-5-carboxylic acid or derivatives - Methoxyaniline - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Aniline or substituted anilines - Alkyl aryl ether - Aminopyridine - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Primary aromatic amine - Pyridine - Pyrimidine - Benzenoid - Heteroaromatic compound - Oxolane - Secondary carboxylic acid amide - Carboxamide group - Organoheterocyclic compound - Secondary amine - Azacycle - Oxacycle - Dialkyl ether - Ether - Organic oxygen compound - Organic oxide - Amine - Carbonyl group - Alkyl halide - Alkyl fluoride - Organic nitrogen compound - Hydrocarbon derivative - Organohalogen compound - Organochloride - Organofluoride - Organonitrogen compound - Organooxygen compound - 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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