Compound Identification
SMILES
CCCOC(=O)C1=CC=C(NC(=S)NC(=O)COC2=C(Br)C3=C(C=C2)C=C(Br)C=C3)C=C1
InChIKey
InChIKey=DTMPPJIPBWHROY-UHFFFAOYSA-N
Formula
C23H20Br2N2O4S
Mass
580.29
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
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 Benzoic acid esters Phenol ethers Benzoyl derivatives Alkyl aryl ethers Aryl bromides Thioureas Carboxylic acid esters Organonitrogen compounds Organobromides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
N-acyl-phenylthiourea - Benzoate ester - Naphthalene - Benzoic acid or derivatives - Benzoyl - Phenol ether - Alkyl aryl ether - Aryl bromide - Aryl halide - Thiourea - Carboxylic acid ester - Carboxylic acid derivative - Ether - Organosulfur compound - Organic oxide - Hydrocarbon derivative - Organohalogen compound - Carbonyl group - Organobromide - Organic oxygen compound - Organic nitrogen compound - Organonitrogen compound - Organooxygen 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