Structure Information
Structure

Compound Identification

SMILES

CNC1=NC(=NC(NC2CCC(CC2)C(=O)NCC2=CC(=CC(Cl)=C2)C(F)(F)F)=N1)C1=CC=CC=C1

InChIKey

InChIKey=JFAHYMJFJWGPMT-UHFFFAOYSA-N

Formula

C25H26ClF3N6O

Mass

518.97

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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

Delta amino acids and derivatives

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Delta amino acid or derivatives - Trifluoromethylbenzene - 2,4-diamine-s-triazine - Amino-1,3,5-triazine - Aminotriazine - Chlorobenzene - Halobenzene - N-aliphatic s-triazine - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Triazine - Benzenoid - 1,3,5-triazine - Heteroaromatic compound - Secondary carboxylic acid amide - Carboxamide group - Organoheterocyclic compound - Azacycle - Organooxygen compound - Organohalogen compound - Hydrocarbon derivative - Organic oxide - Organochloride - Carbonyl group - Amine - Alkyl halide - Alkyl fluoride - Organofluoride - Organic nitrogen compound - Organonitrogen compound - Organic oxygen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as delta amino acids and derivatives. These are compounds containing a carboxylic acid group and an amino group at the C5 carbon atom.

External Descriptors

Not available

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