Compound Identification
SMILES
NC(=O)C1=C(Br)C2=N[C@@H](C[C@@H](N2N1)C(F)(F)F)C1=CC=C(Br)O1
InChIKey
InChIKey=UOBWLALYYFFREC-UJURSFKZSA-N
Formula
C12H9Br2F3N4O2
Mass
458.033
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
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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
Pyrimidinecarboxamides Pyrazolopyrimidines Hydropyrimidines Imidolactams Aryl bromides Furans Heteroaromatic compounds Vinylogous halides Pyrazolines Pyrazoles Amidrazones Primary carboxylic acid amides Bromoalkenes Azacyclic compounds Amidines Oxacyclic compounds Propargyl-type 1,3-dipolar organic compounds Vinyl bromides Carbonyl compounds Hydrocarbon derivatives Organic oxides Organobromides Organofluorides Organopnictogen compounds Alkyl fluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid or derivatives - Pyrazolopyrimidine - Pyrimidinecarboxamide - Aryl bromide - Aryl halide - Hydropyrimidine - 1,4,5,6-tetrahydropyrimidine - Pyrimidine - Imidolactam - Furan - Pyrazole - Pyrazoline - Heteroaromatic compound - Vinylogous halide - Primary carboxylic acid amide - Carboxylic acid amidrazone - Carboxamide group - Propargyl-type 1,3-dipolar organic compound - Vinyl halide - Vinyl bromide - Azacycle - Oxacycle - Amidine - Haloalkene - Organoheterocyclic compound - Bromoalkene - Organic 1,3-dipolar compound - Organic nitrogen compound - Organohalogen compound - Hydrocarbon derivative - Organic oxide - Alkyl fluoride - Organobromide - Carbonyl group - Organopnictogen compound - Organic oxygen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Alkyl halide - 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