Compound Identification
SMILES
COC1=CC(=C(NC2=CC(F)=C(CNC(=O)[C@@]3(CCOC3)NC(=O)C3=CC(N)=CN=C3)N=C2)C=C1)C(F)(F)F
InChIKey
InChIKey=NBUKMHLWZOSEPX-DEOSSOPVSA-N
Formula
C25H24F4N6O4
Mass
548.499
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
-
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 - Alpha amino acids and derivatives
Direct Parent
N-acyl-alpha amino acids and derivatives
Alternative Parents
Trifluoromethylbenzenes Aminophenyl ethers Methoxyanilines Nicotinamides Phenoxy compounds Anisoles Methoxybenzenes Alkyl aryl ethers Aminopyridines and derivatives Primary aromatic amines Aryl fluorides Heteroaromatic compounds Oxolanes Secondary carboxylic acid amides Oxacyclic compounds Dialkyl ethers Azacyclic compounds Secondary amines Hydrocarbon derivatives Carbonyl compounds Alkyl fluorides Organofluorides Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N-acyl-alpha amino acid or derivatives - Trifluoromethylbenzene - Pyridinecarboxamide - Pyridine carboxylic acid or derivatives - Aminophenyl ether - Nicotinamide - Methoxyaniline - Phenol ether - Phenoxy compound - Anisole - Aniline or substituted anilines - Methoxybenzene - Alkyl aryl ether - Aminopyridine - Primary aromatic amine - Benzenoid - Aryl fluoride - Pyridine - Monocyclic benzene moiety - Aryl halide - Oxolane - Heteroaromatic compound - Carboxamide group - Secondary carboxylic acid amide - Secondary amine - Oxacycle - Azacycle - Dialkyl ether - Ether - Organoheterocyclic compound - Primary amine - Alkyl fluoride - Organohalogen compound - Organic nitrogen compound - Carbonyl group - Organofluoride - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Amine - Alkyl halide - Organooxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as n-acyl-alpha amino acids and derivatives. These are compounds containing an alpha amino acid (or a derivative thereof) which bears an acyl group at its terminal nitrogen atom.
External Descriptors
Not available