Compound Identification
SMILES
C[C@@H]1CCCCN1C(=O)C1=C(Br)C2=N[C@H](C[C@H](N2N1)C(F)(F)F)C1=CC=CS1
InChIKey
InChIKey=CFLGJSQXNSOGJB-WZRBSPASSA-N
Formula
C18H20BrF3N4OS
Mass
477.34
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
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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
Pyrazolopyrimidines N-acylpiperidines Hydropyrimidines Imidolactams Vinylogous halides Heteroaromatic compounds Thiophenes Tertiary carboxylic acid amides Pyrazolines Pyrazoles Tertiary amines Amidrazones Amidines Propargyl-type 1,3-dipolar organic compounds Vinyl bromides Azacyclic compounds Bromoalkenes Carbonyl compounds Hydrocarbon derivatives Organic oxides Organobromides Organofluorides Alkyl fluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid or derivatives - N-acyl-piperidine - Pyrazolopyrimidine - Hydropyrimidine - 1,4,5,6-tetrahydropyrimidine - Piperidine - Pyrimidine - Imidolactam - Heteroaromatic compound - Vinylogous halide - Pyrazole - Pyrazoline - Tertiary carboxylic acid amide - Thiophene - Carboxamide group - Carboxylic acid amidrazone - Tertiary amine - Azacycle - Amidine - Vinyl bromide - Organic 1,3-dipolar compound - Organoheterocyclic compound - Vinyl halide - Propargyl-type 1,3-dipolar organic compound - Bromoalkene - Haloalkene - Organic oxide - Organobromide - Organohalogen compound - Organic oxygen compound - Alkyl halide - Alkyl fluoride - Hydrocarbon derivative - Carbonyl group - Amine - Organofluoride - Organonitrogen compound - Organooxygen compound - Organic nitrogen 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