Compound Identification
SMILES
FC1=C(NC(=O)N2CCN(CC3=CC4=C(O3)C=CC(Cl)=C4)CC2)C=C(C=C1)C(F)(F)F
InChIKey
InChIKey=YEBAGVIDMQBFDF-UHFFFAOYSA-N
Formula
C21H18ClF4N3O2
Mass
455.84
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 Piperazine carboxamides Benzofurans Aralkylamines N-alkylpiperazines Fluorobenzenes Aryl chlorides Aryl fluorides Heteroaromatic compounds Furans Ureas Trialkylamines Oxacyclic compounds Azacyclic compounds Organic oxides Alkyl fluorides Organochlorides Organofluorides Carbonyl compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-phenylurea - Trifluoromethylbenzene - Piperazine-1-carboxamide - Benzofuran - Halobenzene - Fluorobenzene - N-alkylpiperazine - Aralkylamine - Aryl chloride - Piperazine - Aryl fluoride - 1,4-diazinane - Aryl halide - Furan - Heteroaromatic compound - Urea - Tertiary aliphatic amine - Tertiary amine - Organoheterocyclic compound - Azacycle - Oxacycle - Alkyl fluoride - Organohalogen compound - Organochloride - Organofluoride - Organonitrogen compound - Organooxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Amine - Alkyl halide - 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