Compound Identification
SMILES
CC(C)C1=CC=C(\C=C\C(=O)NC(=S)NC2=C(C=CC(=C2)C(F)(F)F)N2CCCCC2)C=C1
InChIKey
InChIKey=CBZOLCOULJHPLR-MDWZMJQESA-N
Formula
C25H28F3N3OS
Mass
475.57
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Benzenoids
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Class
Benzene and substituted derivatives
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Subclass
N-phenylthioureas
- Level 5 N-acyl-phenylthioureas
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Subclass
N-phenylthioureas
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
N-phenylthioureas
Intermediate Tree Nodes
Not available
Direct Parent
N-acyl-phenylthioureas
Alternative Parents
Phenylpiperidines Cinnamic acids and derivatives Trifluoromethylbenzenes Monocyclic monoterpenoids Aromatic monoterpenoids Phenylpropanes Cumenes Styrenes Aniline and substituted anilines Dialkylarylamines Thioureas Amino acids and derivatives Azacyclic compounds Alkyl fluorides Hydrocarbon derivatives Organic oxides Organofluorides Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N-acyl-phenylthiourea - Phenylpiperidine - Cinnamic acid or derivatives - Monoterpenoid - P-cymene - Monocyclic monoterpenoid - Trifluoromethylbenzene - Aromatic monoterpenoid - Cumene - Phenylpropane - Tertiary aliphatic/aromatic amine - Styrene - Dialkylarylamine - Aniline or substituted anilines - Piperidine - Amino acid or derivatives - Thiourea - Tertiary amine - Carboxylic acid derivative - Azacycle - Organoheterocyclic compound - Organooxygen compound - Organosulfur compound - Amine - Alkyl halide - Hydrocarbon derivative - Alkyl fluoride - Carbonyl group - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organohalogen compound - Organofluoride - Organonitrogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as n-acyl-phenylthioureas. These are thiourea derivatives where one nitrogen atom of the urea group is linked to a phenyl group and the other is acylated.
External Descriptors
Not available