Compound Identification
SMILES
CC(C)C1=C(OCC(=O)NC(=S)NC2=CC(Cl)=C(O)C(Cl)=C2)C=C(C)C=C1
InChIKey
InChIKey=QYAYXZUTBQOCLE-UHFFFAOYSA-N
Formula
C19H20Cl2N2O3S
Mass
427.34
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
Aromatic monoterpenoids Monocyclic monoterpenoids Cumenes Phenylpropanes Dichlorobenzenes Phenoxy compounds O-chlorophenols Phenol ethers Toluenes Alkyl aryl ethers Aryl chlorides Thioureas Carboxylic acids and derivatives Hydrocarbon derivatives Organic oxides Organochlorides Organonitrogen compounds Carbonyl compounds
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
N-acyl-phenylthiourea - P-cymene - Aromatic monoterpenoid - Monocyclic monoterpenoid - Monoterpenoid - Cumene - Phenylpropane - Phenoxy compound - 1,3-dichlorobenzene - 2-halophenol - Phenol ether - 2-chlorophenol - Alkyl aryl ether - Chlorobenzene - Halobenzene - Toluene - Phenol - Aryl chloride - Aryl halide - Thiourea - Ether - Carboxylic acid derivative - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Carbonyl group - Organosulfur compound - Organooxygen compound - Organohalogen compound - Organochloride - Organonitrogen 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