Compound Identification
SMILES
NC1=C(C=NC2=C(C=NN12)C1=CC2=C(OCO2)C=C1)C1=CC=C(NC(=O)NC2=CC=CC(=C2)C(F)(F)F)C=C1
InChIKey
InChIKey=FFCFHBVSGILIJY-UHFFFAOYSA-N
Formula
C27H19F3N6O3
Mass
532.483
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass N-phenylureas
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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
Trifluoromethylbenzenes Pyrazolo[1,5-a]pyrimidines Benzodioxoles Aminopyrimidines and derivatives Primary aromatic amines Heteroaromatic compounds Pyrazoles Ureas Oxacyclic compounds Azacyclic compounds Acetals Organopnictogen compounds Organofluorides Organic oxides Hydrocarbon derivatives Carbonyl compounds Alkyl fluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-phenylurea - Trifluoromethylbenzene - Benzodioxole - Pyrazolo[1,5-a]pyrimidine - Pyrazolopyrimidine - Aminopyrimidine - Primary aromatic amine - Pyrimidine - Heteroaromatic compound - Azole - Pyrazole - Urea - Oxacycle - Azacycle - Organoheterocyclic compound - Acetal - Hydrocarbon derivative - Primary amine - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Organopnictogen compound - Carbonyl group - Organic oxygen compound - Organic oxide - Organic nitrogen compound - Amine - Alkyl halide - Alkyl fluoride - Aromatic heteropolycyclic 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