Compound Identification
SMILES
CC(C)C1=CC=C(C=C1)C(=O)NC(=S)NC1=CC(Br)=C(O)C(Br)=C1
InChIKey
InChIKey=XTKZHSCIUJOXCH-UHFFFAOYSA-N
Formula
C17H16Br2N2O2S
Mass
472.2
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
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
Aromatic monoterpenoids Monocyclic monoterpenoids Phenylpropanes Benzoic acids and derivatives Cumenes Benzoyl derivatives O-bromophenols Bromobenzenes Aryl bromides Thioureas Carboxylic acids and derivatives Hydrocarbon derivatives Organobromides Organonitrogen compounds Organooxygen compounds Organic oxides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
N-acyl-phenylthiourea - P-cymene - Aromatic monoterpenoid - Monocyclic monoterpenoid - Monoterpenoid - Benzoic acid or derivatives - Cumene - Phenylpropane - Benzoyl - 2-halophenol - 2-bromophenol - Bromobenzene - Halobenzene - Phenol - Aryl halide - Aryl bromide - Thiourea - Carboxylic acid derivative - Organooxygen compound - Organosulfur compound - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organobromide - Organohalogen compound - Aromatic homomonocyclic 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