Compound Identification
SMILES
OC1=C(Cl)C=C(NC(=S)NC(=O)COC2=CC=CC=C2Cl)C=C1Cl
InChIKey
InChIKey=JDWBXXHMCVSPIW-UHFFFAOYSA-N
Formula
C15H11Cl3N2O3S
Mass
405.67
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
Phenoxy compounds Phenol ethers O-chlorophenols Dichlorobenzenes Alkyl aryl ethers Aryl chlorides Thioureas Carboxylic acids and derivatives Organonitrogen compounds Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
N-acyl-phenylthiourea - 1,3-dichlorobenzene - Phenoxy compound - 2-halophenol - 2-chlorophenol - Phenol ether - Alkyl aryl ether - Chlorobenzene - Halobenzene - Phenol - Aryl chloride - Aryl halide - Thiourea - Ether - Carboxylic acid derivative - Organonitrogen compound - Organochloride - Organohalogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Organooxygen compound - Organosulfur 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