Compound Identification
SMILES
COC1=CC=C(CNC(=O)CN2CCC(CC2)N=C(N)NC(=O)C2=C(N)N=C(N)C(Cl)=N2)C=C1
InChIKey
InChIKey=MEAWJDKFBYIQJH-UHFFFAOYSA-N
Formula
C21H28ClN9O3
Mass
489.97
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organic acids and derivatives
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Class
Carboxylic acids and derivatives
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Subclass
Amino acids, peptides, and analogues
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Level 5
Amino acids and derivatives
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Level 6
Alpha amino acids and derivatives
- Level 7 Alpha amino acid amides
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Level 6
Alpha amino acids and derivatives
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Level 5
Amino acids and derivatives
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Subclass
Amino acids, peptides, and analogues
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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 amides
Alternative Parents
Pyrazinecarboxamides Methoxybenzenes Anisoles Phenoxy compounds Aminopyrazines Alkyl aryl ethers Aryl chlorides Imidolactams Piperidines Vinylogous amides Heteroaromatic compounds Trialkylamines Secondary carboxylic acid amides Guanidines Carboximidamides Azacyclic compounds Propargyl-type 1,3-dipolar organic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organochlorides Primary amines
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alpha-amino acid amide - Pyrazine carboxylic acid or derivatives - Pyrazinecarboxamide - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Alkyl aryl ether - Aminopyrazine - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Piperidine - Pyrazine - Benzenoid - Imidolactam - Vinylogous amide - Heteroaromatic compound - Tertiary amine - Tertiary aliphatic amine - Carboxamide group - Guanidine - Secondary carboxylic acid amide - Organoheterocyclic compound - Azacycle - Carboximidamide - Organic 1,3-dipolar compound - Ether - Propargyl-type 1,3-dipolar organic compound - Hydrocarbon derivative - Organohalogen compound - Organochloride - Carbonyl group - Amine - Organic oxygen compound - Organic nitrogen compound - Organonitrogen compound - Organic oxide - Primary amine - Organooxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as alpha amino acid amides. These are amide derivatives of alpha amino acids.
External Descriptors
Not available