Compound Identification
SMILES
O[C@@H](CNCCNC(=O)NC1=CC=C(OCCCF)C=C1)COC1=CC=CC=C1C#N
InChIKey
InChIKey=IKYZBDHXQOQUNJ-IBGZPJMESA-N
Formula
C22H27FN4O4
Mass
430.48
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass N-phenylureas
-
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
Phenoxy compounds Phenol ethers Benzonitriles Alkyl aryl ethers Ureas Secondary alcohols 1,2-aminoalcohols Nitriles Dialkylamines Organofluorides Organic oxides Hydrocarbon derivatives Carbonyl compounds Alkyl fluorides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
N-phenylurea - Phenoxy compound - Benzonitrile - Phenol ether - Alkyl aryl ether - 1,2-aminoalcohol - Secondary alcohol - Urea - Secondary amine - Secondary aliphatic amine - Ether - Carbonitrile - Nitrile - Hydrocarbon derivative - Organohalogen compound - Organofluoride - Organonitrogen compound - Cyanide - Organooxygen compound - Organic oxide - Carbonyl group - Organic oxygen compound - Amine - Alkyl halide - Alkyl fluoride - Alcohol - Organic nitrogen compound - Aromatic homomonocyclic 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