Structure Information
Structure

Compound Identification

SMILES

NC(=O)[C@H](NC(=O)C1=CC(=NC2=CC=NN12)C(=O)NCC1=CC2=C(OCC(=O)N2)C=C1)C1=CC=C(F)C=C1

InChIKey

InChIKey=CDUHFNGHTZRQOZ-JOCHJYFZSA-N

Formula

C25H20FN7O5

Mass

517.477

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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 heteropolycyclic compounds

Substituents

N-acyl-alpha amino acid or derivatives - Benzoxazinone - Benzoxazine - Benzomorpholine - Phenylacetamide - Pyrazolo[1,5-a]pyrimidine - Pyrazolopyrimidine - Pyrimidine-6-carboxylic acid or derivatives - 2-heteroaryl carboxamide - Halobenzene - Alkyl aryl ether - Fluorobenzene - Benzenoid - Aryl fluoride - Monocyclic benzene moiety - Oxazinane - Aryl halide - Pyrimidine - Heteroaromatic compound - Azole - Pyrazole - Carboxamide group - Primary carboxylic acid amide - Lactam - Secondary carboxylic acid amide - Azacycle - Oxacycle - Ether - Organoheterocyclic compound - Organic nitrogen compound - Carbonyl group - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Aromatic heteropolycyclic 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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