Compound Identification
SMILES
CC[C@H](CC#N)NC(=O)C1=CC=C(NC(=O)N2CC3=C(C2)C=C(F)C=C3)C=C1
InChIKey
InChIKey=XASFGBHKTAKTDV-GOSISDBHSA-N
Formula
C21H21FN4O2
Mass
380.423
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
Isoindolines Isoindoles Benzamides Benzoyl derivatives Aryl fluorides Ureas Tertiary amines Secondary carboxylic acid amides Amino acids and derivatives Nitriles Azacyclic compounds Organofluorides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-phenylurea - Benzamide - Benzoic acid or derivatives - Isoindoline - Isoindole - Isoindole or derivatives - Benzoyl - Aryl fluoride - Aryl halide - Amino acid or derivatives - Carboxamide group - Urea - Tertiary amine - Secondary carboxylic acid amide - Nitrile - Carbonitrile - Carboxylic acid derivative - Azacycle - Organoheterocyclic compound - Organic oxygen compound - Organic nitrogen compound - Amine - Carbonyl group - Hydrocarbon derivative - Organic oxide - Cyanide - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - 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