Compound Identification
SMILES
FC(F)(F)C1=CC(=CN2C(Cl)=C(N=C12)C(=O)N1CCN(C2CC3C(C2)C3C#N)C(=O)C1)C1CC1
InChIKey
InChIKey=NDNIVLIBQLWMHU-UHFFFAOYSA-N
Formula
C23H21ClF3N5O2
Mass
491.9
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
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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
Imidazo[1,2-a]pyridines Imidazopyridines 2-heteroaryl carboxamides Carbonylimidazoles N-alkylpiperazines Pyridines and derivatives Aryl chlorides N-substituted imidazoles Vinylogous halides Vinylogous amides Tertiary carboxylic acid amides Heteroaromatic compounds Lactams Nitriles Azacyclic compounds Hydrocarbon derivatives Organic oxides Carbonyl compounds Organochlorides Alkyl fluorides Organofluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid or derivatives - Imidazopyridine - Imidazo[1,2-a]pyridine - 2-heteroaryl carboxamide - N-alkylpiperazine - Imidazole-4-carbonyl group - N-substituted imidazole - Aryl chloride - Piperazine - Pyridine - Aryl halide - 1,4-diazinane - Tertiary carboxylic acid amide - Vinylogous halide - Vinylogous amide - Imidazole - Heteroaromatic compound - Azole - Lactam - Carboxamide group - Azacycle - Organoheterocyclic compound - Carbonitrile - Nitrile - Organofluoride - Organonitrogen compound - Organooxygen compound - Alkyl halide - Alkyl fluoride - Hydrocarbon derivative - Carbonyl group - Organic oxide - Cyanide - Organic oxygen compound - Organochloride - Organic nitrogen compound - Organohalogen compound - 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