Compound Identification
SMILES
C[C@H]1COCCN1C1=NC(=NC2=C1CN(C2)C(O)=O)C1=CC=C(NC(=O)NCCF)C=C1
InChIKey
InChIKey=OZLGARAVTRSZRQ-ZDUSSCGKSA-N
Formula
C21H25FN6O4
Mass
444.467
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
Pyrrolopyrimidines Dialkylarylamines Aminopyrimidines and derivatives Morpholines Imidolactams Heteroaromatic compounds Ureas Carbamic acids Oxacyclic compounds Azacyclic compounds Dialkyl ethers Carbonyl compounds Hydrocarbon derivatives Organic oxides Organofluorides Alkyl fluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-phenylurea - Pyrrolopyrimidine - Dialkylarylamine - Aminopyrimidine - Morpholine - Oxazinane - Pyrimidine - Imidolactam - Heteroaromatic compound - Urea - Carbamic acid - Carbamic acid derivative - Azacycle - Oxacycle - Dialkyl ether - Ether - Organoheterocyclic compound - Alkyl fluoride - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Carbonyl group - 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