Structure Information
Structure

Compound Identification

SMILES

OCC(NC(=O)C1=NC2=CC=CC=C2C=C1)C(=O)N1CCN(CC1)C1=NC=CC=N1

InChIKey

InChIKey=GXAIBPVKIVWVLV-UHFFFAOYSA-N

Formula

C21H22N6O3

Mass

406.446

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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 - Quinoline-2-carboxamide - Alpha-amino acid amide - N-arylpiperazine - Quinoline - Pyridine carboxylic acid or derivatives - 2-heteroaryl carboxamide - Dialkylarylamine - Aminopyrimidine - 1,4-diazinane - Piperazine - Pyridine - Pyrimidine - Benzenoid - Heteroaromatic compound - Tertiary carboxylic acid amide - Secondary carboxylic acid amide - Carboxamide group - Organoheterocyclic compound - Azacycle - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Organic oxide - Alcohol - Organic nitrogen compound - Carbonyl group - Primary alcohol - Hydrocarbon derivative - Amine - 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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