Compound Identification
SMILES
CN1C=C(CNC(=O)C2=CC3=NC(CC(N3N2)C(F)(F)F)C2=CC=CS2)C(C)=N1
InChIKey
InChIKey=HPRWNVMZRZVORC-UHFFFAOYSA-N
Formula
C18H19F3N6OS
Mass
424.45
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
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
-
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 Imidolactams Hydropyrimidines Thiophenes Pyrazolines Pyrazoles Heteroaromatic compounds Secondary carboxylic acid amides Amidrazones Propargyl-type 1,3-dipolar organic compounds Amidines Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organofluorides Alkyl fluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid or derivatives - Pyrazolopyrimidine - Pyrimidinecarboxamide - Hydropyrimidine - 1,4,5,6-tetrahydropyrimidine - Pyrimidine - Imidolactam - Azole - Pyrazole - Pyrazoline - Heteroaromatic compound - Thiophene - Carboxylic acid amidrazone - Secondary carboxylic acid amide - Carboxamide group - Azacycle - Amidine - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Hydrocarbon derivative - Organohalogen compound - Organic oxide - Organic oxygen compound - Organofluoride - Carbonyl group - Alkyl fluoride - Organonitrogen compound - Organooxygen compound - Alkyl halide - 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