Compound Identification
SMILES
CC(C)C1=CC=C(C=C1)C(=O)NC(=S)NC1=CC=C(C=C1)N1CCN(C)CC1
InChIKey
InChIKey=WBDGEBRBLPRMAV-UHFFFAOYSA-N
Formula
C22H28N4OS
Mass
396.55
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
N-arylpiperazines Phenylpiperazines Aromatic monoterpenoids Monocyclic monoterpenoids Benzoic acids and derivatives Cumenes Phenylpropanes Dialkylarylamines Aniline and substituted anilines Benzoyl derivatives N-methylpiperazines Trialkylamines Thioureas Amino acids and derivatives Azacyclic compounds Hydrocarbon derivatives Organic oxides Organooxygen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N-acyl-phenylthiourea - Phenylpiperazine - N-arylpiperazine - P-cymene - Aromatic monoterpenoid - Monocyclic monoterpenoid - Monoterpenoid - Benzoic acid or derivatives - Cumene - Phenylpropane - Dialkylarylamine - Benzoyl - Tertiary aliphatic/aromatic amine - Aniline or substituted anilines - N-methylpiperazine - N-alkylpiperazine - 1,4-diazinane - Piperazine - Amino acid or derivatives - Tertiary amine - Thiourea - Tertiary aliphatic amine - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Amine - Organic oxygen compound - Organic nitrogen 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