Compound Identification
SMILES
CCC1=CC=C(NC(=O)N2CCC(CNC(=O)C3=C(C)ON=C3C3=C(F)C=CC=C3Cl)CC2)C=C1
InChIKey
InChIKey=PSTUXLITOWXKOL-UHFFFAOYSA-N
Formula
C26H28ClFN4O3
Mass
498.98
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
Piperidinecarboxamides Chlorobenzenes Fluorobenzenes Aryl chlorides Aryl fluorides Heteroaromatic compounds Isoxazoles Secondary carboxylic acid amides Ureas Oxacyclic compounds Azacyclic compounds Organic oxides Hydrocarbon derivatives Organonitrogen compounds Carbonyl compounds Organochlorides Organofluorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N-phenylurea - Piperidinecarboxamide - 1-piperidinecarboxamide - Chlorobenzene - Fluorobenzene - Halobenzene - Aryl chloride - Aryl fluoride - Aryl halide - Piperidine - Azole - Heteroaromatic compound - Isoxazole - Carboxamide group - Urea - Secondary carboxylic acid amide - Oxacycle - Carboxylic acid derivative - Azacycle - Organoheterocyclic compound - Organooxygen compound - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organonitrogen compound - Organofluoride - Organohalogen compound - Organochloride - 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