Compound Identification
SMILES
CCCC1=NC(C)=NC(C(=O)N2CCN(C(C)C2)C(=O)NC2=CC(Cl)=C(F)C=C2)=C1C(=O)OCC
InChIKey
InChIKey=WQEDRCJOZUQHFX-UHFFFAOYSA-N
Formula
C24H29ClFN5O4
Mass
505.98
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
Pyrimidinecarboxylic acids Piperazine carboxamides 2-heteroaryl carboxamides Fluorobenzenes Chlorobenzenes Aryl chlorides Aryl fluorides Tertiary carboxylic acid amides Heteroaromatic compounds Ureas Carboxylic acid esters Azacyclic compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides Organochlorides Organofluorides Organonitrogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N-phenylurea - Piperazine-1-carboxamide - Pyrimidine-5-carboxylic acid - Pyrimidine-5-carboxylic acid or derivatives - Pyrimidine-6-carboxylic acid or derivatives - 2-heteroaryl carboxamide - Chlorobenzene - Halobenzene - Fluorobenzene - Pyrimidine - Aryl chloride - Aryl halide - Aryl fluoride - Piperazine - 1,4-diazinane - Tertiary carboxylic acid amide - Heteroaromatic compound - Carboxamide group - Carboxylic acid ester - Urea - Organoheterocyclic compound - Azacycle - Carboxylic acid derivative - Organohalogen compound - Organooxygen compound - Organic oxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Carbonyl group - Organic oxide - Organochloride - Organofluoride - Organonitrogen compound - 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