Compound Identification
SMILES
ClC1=C(SC2=C1C=CC(Cl)=C2)C(=O)NC(=S)NC1=CC=C(C=C1)C1=NC2=C(O1)C=CC=N2
InChIKey
InChIKey=POQVWKNCACODQP-UHFFFAOYSA-N
Formula
C22H12Cl2N4O2S2
Mass
499.38
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
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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 1-benzothiophenes Oxazolopyridines Thiophene carboxamides Aryl chlorides Pyridines and derivatives Vinylogous halides Heteroaromatic compounds Thioureas Carboxylic acids and derivatives Azacyclic compounds Oxacyclic compounds Organooxygen compounds Organonitrogen compounds Organochlorides Organic oxides Hydrocarbon derivatives Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-acyl-phenylthiourea - Phenyl-1,3-oxazole - Benzothiophene - 1-benzothiophene - 1,3-oxazolopyridine - Thiophene carboxylic acid or derivatives - Thiophene carboxamide - Aryl chloride - Aryl halide - Pyridine - Azole - Heteroaromatic compound - Oxazole - Vinylogous halide - Thiophene - Thiourea - Carboxylic acid derivative - Oxacycle - Azacycle - Organoheterocyclic compound - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Hydrocarbon derivative - Organic oxide - Organosulfur compound - Organic nitrogen compound - Organic oxygen compound - Organopnictogen 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