Compound Identification
SMILES
CSCCCC1(C)CN(N=C1C1=CC=C(Cl)C=C1)C(=O)NC1=CC(Br)=C(C=C1)C(F)(F)F
InChIKey
InChIKey=VQCCTURAJIOUIC-UHFFFAOYSA-N
Formula
C22H22BrClF3N3OS
Mass
548.85
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
Trifluoromethylbenzenes Bromobenzenes Chlorobenzenes Semicarbazones Aryl bromides Aryl chlorides Pyrazolines Sulfenyl compounds Azacyclic compounds Dialkylthioethers Hydrocarbon derivatives Carbonyl compounds Organic oxides Organobromides Organochlorides Organofluorides Alkyl fluorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Trifluoromethylbenzene - N-phenylurea - Bromobenzene - Chlorobenzene - Halobenzene - Aryl bromide - Aryl chloride - Aryl halide - Semicarbazone - Semicarbazide - Pyrazoline - Azacycle - Organoheterocyclic compound - Dialkylthioether - Sulfenyl compound - Thioether - Alkyl fluoride - Organofluoride - Organochloride - Organobromide - Organohalogen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Alkyl halide - 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