Compound Identification
SMILES
ClC1=C(Cl)C=C(NC(=S)NC(=O)COC2=C(Br)C3=CC=CC=C3C=C2)C=C1
InChIKey
InChIKey=YHCWMUWWOVDJHD-UHFFFAOYSA-N
Formula
C19H13BrCl2N2O2S
Mass
484.19
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
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
Naphthalenes Phenol ethers Dichlorobenzenes Alkyl aryl ethers Aryl chlorides Aryl bromides Thioureas Carboxylic acids and derivatives Organonitrogen compounds Organochlorides Organobromides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
N-acyl-phenylthiourea - Naphthalene - Phenol ether - 1,2-dichlorobenzene - Alkyl aryl ether - Chlorobenzene - Halobenzene - Aryl bromide - Aryl chloride - Aryl halide - Thiourea - Carboxylic acid derivative - Ether - Organochloride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organobromide - Organohalogen compound - Aromatic homopolycyclic 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