Compound Identification
SMILES
CC(C)C1=C(OCC(=O)NC(=S)NC2=CC=C(Br)C=C2)C=C(C)C(Br)=C1
InChIKey
InChIKey=HYGHTFMUAQOKTN-UHFFFAOYSA-N
Formula
C19H20Br2N2O2S
Mass
500.25
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 Cumenes Phenylpropanes Phenoxy compounds Phenol ethers Alkyl aryl ethers Bromobenzenes Toluenes Aryl bromides Thioureas Carboxylic acids and derivatives Organobromides Organic oxides Hydrocarbon derivatives Carbonyl compounds Organonitrogen compounds
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
N-acyl-phenylthiourea - P-cymene - Aromatic monoterpenoid - Monocyclic monoterpenoid - Monoterpenoid - Cumene - Phenylpropane - Phenol ether - Phenoxy compound - Toluene - Bromobenzene - Alkyl aryl ether - Halobenzene - Aryl bromide - Aryl halide - Thiourea - Ether - Carboxylic acid derivative - Organic oxide - Organic oxygen compound - Organobromide - Organonitrogen compound - Carbonyl group - Organooxygen compound - Organosulfur compound - Organic nitrogen compound - Hydrocarbon derivative - 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