Compound Identification
SMILES
CC1(C[C@@H](N)C(=O)N2C[C@H](F)CC2C(=O)NCC2=C(C=CC(Cl)=C2F)N2C=NC=N2)CC1
InChIKey
InChIKey=XLRZJALYTWCGRF-FIOAXKIRSA-N
Formula
C21H25ClF2N6O2
Mass
466.92
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
Peptides
- Level 6 Dipeptides
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Level 5
Peptides
-
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
Peptides
Direct Parent
Dipeptides
Alternative Parents
Proline and derivatives Alpha amino acid amides Phenyl-1,2,4-triazoles Pyrrolidinecarboxamides N-acylpyrrolidines Chlorobenzenes Fluorobenzenes Aryl chlorides Aryl fluorides Tertiary carboxylic acid amides Heteroaromatic compounds Secondary carboxylic acid amides Azacyclic compounds Hydrocarbon derivatives Carbonyl compounds Monoalkylamines Organic oxides Organochlorides Organofluorides Alkyl fluorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alpha-dipeptide - Proline or derivatives - Alpha-amino acid amide - Phenyl-1,2,4-triazole - Phenyltriazole - Alpha-amino acid or derivatives - N-acylpyrrolidine - Pyrrolidine carboxylic acid or derivatives - Pyrrolidine-2-carboxamide - Chlorobenzene - Fluorobenzene - Halobenzene - Aryl chloride - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Benzenoid - 1,2,4-triazole - Triazole - Tertiary carboxylic acid amide - Pyrrolidine - Azole - Heteroaromatic compound - Secondary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Organoheterocyclic compound - Azacycle - Amine - Hydrocarbon derivative - Organic oxide - Primary aliphatic amine - Carbonyl group - Organic oxygen compound - Organohalogen compound - Organic nitrogen compound - Alkyl halide - Alkyl fluoride - Organochloride - Organofluoride - Organonitrogen compound - Organooxygen compound - Primary amine - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as dipeptides. These are organic compounds containing a sequence of exactly two alpha-amino acids joined by a peptide bond.
External Descriptors
Not available