Compound Identification
SMILES
CC1=CC=C(CN(CC2=CC=CC=C2)C(=O)CN(C2CCCCC2)C(=O)NC2=CC=CC=C2C(F)(F)F)S1
InChIKey
InChIKey=USDZLDRACHMPSD-UHFFFAOYSA-N
Formula
C29H32F3N3O2S
Mass
543.65
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 Alpha amino acids and derivatives 2,5-disubstituted thiophenes Tertiary carboxylic acid amides Heteroaromatic compounds Ureas Organonitrogen compounds Organofluorides Organic oxides Hydrocarbon derivatives Carbonyl compounds Alkyl fluorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alpha-amino acid or derivatives - Trifluoromethylbenzene - N-phenylurea - 2,5-disubstituted thiophene - Tertiary carboxylic acid amide - Heteroaromatic compound - Thiophene - Carboxamide group - Urea - Carboxylic acid derivative - Organoheterocyclic compound - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Organic oxide - Alkyl fluoride - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - 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