Structure Information
Structure

Compound Identification

SMILES

CN1C2=CC=CC=C2C(=NC(NC(=O)C2=C(Br)C(NC(=O)C3=CC=CC=C3Cl)=NN2)C1=O)C1=CC=CC=C1

InChIKey

InChIKey=ASROEUPWAARGEI-UHFFFAOYSA-N

Formula

C27H20BrClN6O3

Mass

591.85

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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 - Benzodiazepine - 1,4-benzodiazepine - 2-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzoic acid or derivatives - Benzamide - Pyrazole-5-carboxamide - 2-heteroaryl carboxamide - Benzoyl - Chlorobenzene - Halobenzene - Aryl halide - Aryl chloride - Aryl bromide - Monocyclic benzene moiety - Imidolactam - Benzenoid - Pyrazole - Azole - Tertiary carboxylic acid amide - Vinylogous halide - Heteroaromatic compound - Secondary carboxylic acid amide - Ketimine - Carboxamide group - Lactam - Organoheterocyclic compound - Azacycle - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organic nitrogen compound - Imine - Carbonyl group - Organohalogen compound - Organobromide - Organochloride - 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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