Compound Identification
SMILES
CC(C)(SC1=CC2=C(C[C@@H](C2)NC(=O)NC2=CC=C(OC(F)(F)F)C=C2)C=C1)C(O)=O
InChIKey
InChIKey=CZJAPAIWDHFJDF-HNNXBMFYSA-N
Formula
C21H21F3N2O4S
Mass
454.46
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
Indanes Thiophenol ethers Phenoxy compounds Phenol ethers Alkylarylthioethers Ureas Trihalomethanes Sulfenyl compounds Carboxylic acids Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives Organofluorides Carbonyl compounds Organonitrogen compounds Alkyl fluorides
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
N-phenylurea - Indane - Phenoxy compound - Aryl thioether - Phenol ether - Thiophenol ether - Alkylarylthioether - Trihalomethane - Urea - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Thioether - Sulfenyl compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Organic oxygen compound - Organic nitrogen compound - Alkyl halide - Organic oxide - Carbonyl group - Halomethane - Hydrocarbon derivative - Alkyl fluoride - Aromatic homopolycyclic 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