Compound Identification
SMILES
C[C@H](NC1=NC=CC(=N1)N(C(=O)NC1=CC(F)=CC(F)=C1F)C1=CC=C(F)C=C1)C(C)(C)O
InChIKey
InChIKey=SUJVIJWAXDOJFN-LBPRGKRZSA-N
Formula
C22H21F4N5O2
Mass
463.437
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass N-phenylureas
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
N-phenylureas
Intermediate Tree Nodes
Not available
Direct Parent
N-phenylureas
Alternative Parents
Fluorobenzenes Aminopyrimidines and derivatives Imidolactams Aryl fluorides Tertiary alcohols Heteroaromatic compounds Ureas Azacyclic compounds Organofluorides Organic oxides Hydrocarbon derivatives Carbonyl compounds Amines
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N-phenylurea - Aminopyrimidine - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - Imidolactam - Pyrimidine - Heteroaromatic compound - Tertiary alcohol - Urea - Azacycle - Organoheterocyclic compound - Alcohol - Organofluoride - Organohalogen compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Amine - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as n-phenylureas. These are compounds containing a N-phenylurea moiety, which is structurally characterized by a phenyl group linked to one nitrogen atom of a urea group.
External Descriptors
Not available