Compound Identification
SMILES
CCOC(=O)C1(CN(C)C2=CC=CC=C2)N2NC=C(C#N)C2=NC=C1C(C)=O
InChIKey
InChIKey=WKYJSCRCAVFVPH-UHFFFAOYSA-N
Formula
C20H21N5O3
Mass
379.42
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
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Class
Carboxylic acids and derivatives
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Subclass
Amino acids, peptides, and analogues
- Level 5 Amino acids and derivatives
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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
Direct Parent
Alpha amino acids and derivatives
Alternative Parents
Pyrazolopyrimidines Aniline and substituted anilines Dialkylarylamines Gamma-keto acids and derivatives Gamma-amino ketones Imidolactams Hydropyrimidines Pyrazolines Pyrazoles Amidrazones Carboxylic acid esters Nitriles Amidines Azacyclic compounds Propargyl-type 1,3-dipolar organic compounds Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid or derivatives - Pyrazolopyrimidine - Gamma-keto acid - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Aniline or substituted anilines - Monocyclic benzene moiety - Gamma-aminoketone - Hydropyrimidine - 1,6-dihydropyrimidine - Keto acid - Pyrimidine - Benzenoid - Imidolactam - Pyrazoline - Pyrazole - Carboxylic acid ester - Ketone - Tertiary amine - Carboxylic acid amidrazone - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Nitrile - Carbonitrile - Monocarboxylic acid or derivatives - Amidine - Organic oxide - Amine - Organic oxygen compound - Carbonyl group - Organonitrogen compound - Organooxygen compound - Cyanide - Organic nitrogen compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as alpha amino acids and derivatives. These are amino acids in which the amino group is attached to the carbon atom immediately adjacent to the carboxylate group (alpha carbon), or a derivative thereof.
External Descriptors
Not available