Compound Identification
SMILES
CCCCOC1=CC=CC(=C1)C(=O)NC(=S)NC1=C(C)C=CC(=C1)C1=NC2=C(O1)C=CC(Cl)=C2
InChIKey
InChIKey=XJJGMXAYNLCTHT-UHFFFAOYSA-N
Formula
C26H24ClN3O3S
Mass
494.01
Taxonomic Classification
Taxonomy Tree
-
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
Phenyl-1,3-oxazoles Benzoic acids and derivatives Benzoxazoles Phenoxy compounds Phenol ethers Benzoyl derivatives Toluenes Alkyl aryl ethers Aryl chlorides Heteroaromatic compounds Thioureas Oxacyclic compounds Azacyclic compounds Carboxylic acids and derivatives Organochlorides Organonitrogen compounds Organic oxides Organopnictogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-acyl-phenylthiourea - Phenyl-1,3-oxazole - Benzoic acid or derivatives - Benzoxazole - Phenoxy compound - Benzoyl - Phenol ether - Alkyl aryl ether - Toluene - Aryl chloride - Aryl halide - Azole - Heteroaromatic compound - Oxazole - Thiourea - Oxacycle - Azacycle - Carboxylic acid derivative - Ether - Organoheterocyclic compound - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Aromatic heteropolycyclic 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