Compound Identification
SMILES
CCCN1C(=O)NC(C2=CC=C(NC(=O)NC3=CC=C(C=C3)C#N)C=C2)C(C(=O)OCC)=C1C
InChIKey
InChIKey=KFUYXYJLYCOCQF-UHFFFAOYSA-N
Formula
C25H27N5O4
Mass
461.522
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
Hydropyrimidine carboxylic acids and derivatives Benzonitriles Pyrimidones Vinylogous amides Enoate esters Ureas Nitriles Monocarboxylic acids and derivatives Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N-phenylurea - Hydropyrimidine carboxylic acid derivative - Benzonitrile - Pyrimidone - Hydropyrimidine - 1,2,3,4-tetrahydropyrimidine - Pyrimidine - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Vinylogous amide - Urea - Carboxylic acid ester - Carboxylic acid derivative - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Carbonitrile - Nitrile - Azacycle - Organic oxide - Cyanide - Hydrocarbon derivative - Carbonyl group - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organic oxygen 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