Compound Identification
SMILES
CC(C)(CC(=O)N[C@H]1C[C@@H]1C1=CC=C(Cl)C=C1)NCC(=O)N1CCC[C@H]1C#N
InChIKey
InChIKey=ZGQKJMNPBMEVCC-KSZLIROESA-N
Formula
C21H27ClN4O2
Mass
402.92
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
-
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
-
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 amides
Alternative Parents
Beta amino acids and derivatives N-acylpyrrolidines Chlorobenzenes N-acyl amines Aryl chlorides Tertiary carboxylic acid amides Tertiary amines Secondary carboxylic acid amides Nitriles Dialkylamines Azacyclic compounds Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alpha-amino acid amide - Beta amino acid or derivatives - N-acylpyrrolidine - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Fatty acyl - Fatty amide - Benzenoid - N-acyl-amine - Tertiary carboxylic acid amide - Pyrrolidine - Carboxamide group - Tertiary amine - Secondary carboxylic acid amide - Azacycle - Nitrile - Carbonitrile - Secondary amine - Secondary aliphatic amine - Organoheterocyclic compound - Organooxygen compound - Amine - Organohalogen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Cyanide - Organic oxygen compound - Organochloride - Organonitrogen 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