Compound Identification
SMILES
CCOC(=O)CNC1=C(C(=O)N(CC)CC)C(N2CCN(C)CC2)=C2C=CC=NC2=N1
InChIKey
InChIKey=YMELYSYRKVWCGS-UHFFFAOYSA-N
Formula
C22H32N6O3
Mass
428.537
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
Class
Carboxylic acids and derivatives
-
Subclass
Amino acids, peptides, and analogues
-
Level 5
Amino acids and derivatives
-
Level 6
Alpha amino acids and derivatives
- Level 7 Alpha amino acid esters
-
Level 6
Alpha amino acids and derivatives
-
Level 5
Amino acids and derivatives
-
Subclass
Amino acids, peptides, and analogues
-
Class
Carboxylic acids and derivatives
-
Superclass
Organic acids and derivatives
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
Alpha amino acid esters
Alternative Parents
N-arylpiperazines Pyridinylpiperazines Naphthyridines Pyridinecarboxylic acids and derivatives Dialkylarylamines Aminopyridines and derivatives N-methylpiperazines Secondary alkylarylamines Imidolactams Tertiary carboxylic acid amides Vinylogous amides Heteroaromatic compounds Trialkylamines Carboxylic acid esters Monocarboxylic acids and derivatives Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid ester - Pyridinylpiperazine - N-arylpiperazine - Naphthyridine - Pyridine carboxylic acid or derivatives - Dialkylarylamine - Aminopyridine - Secondary aliphatic/aromatic amine - N-methylpiperazine - N-alkylpiperazine - Pyridine - Piperazine - 1,4-diazinane - Imidolactam - Tertiary carboxylic acid amide - Vinylogous amide - Heteroaromatic compound - Tertiary amine - Carboxamide group - Tertiary aliphatic amine - Carboxylic acid ester - Azacycle - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Secondary amine - Amine - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Carbonyl group - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as alpha amino acid esters. These are ester derivatives of alpha amino acids.
External Descriptors
Not available