Compound Identification
SMILES
COC1=CC=CC=C1N(C(N)=O)C1=NC(=NC2=C1N=CN2C)C1=C(C)C=C(F)C=C1
InChIKey
InChIKey=PTEBXEWWBOWMAM-UHFFFAOYSA-N
Formula
C21H19FN6O2
Mass
406.421
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
Methoxyanilines Purines and purine derivatives Anisoles Methoxybenzenes Phenoxy compounds Alkyl aryl ethers Fluorobenzenes Toluenes Aryl fluorides N-substituted imidazoles Imidolactams Pyrimidines and pyrimidine derivatives Heteroaromatic compounds Ureas Tertiary amines Azacyclic compounds Organofluorides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-phenylurea - Imidazopyrimidine - Purine - Methoxyaniline - Anisole - Phenoxy compound - Phenol ether - Methoxybenzene - Alkyl aryl ether - Fluorobenzene - Halobenzene - Toluene - Pyrimidine - Imidolactam - Aryl fluoride - Aryl halide - N-substituted imidazole - Heteroaromatic compound - Azole - Imidazole - Tertiary amine - Urea - Azacycle - Organoheterocyclic compound - Ether - Hydrocarbon derivative - Organic nitrogen compound - Amine - Organic oxygen compound - Carbonyl group - Organic oxide - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - 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