Compound Identification
SMILES
CC1=C(NC(=S)NC(=O)C2=CC=C(C=C2)C(C)(C)C)C=CC(=C1)C1=NC2=C(O1)C=CC=N2
InChIKey
InChIKey=QPIINSSMCRCHQO-UHFFFAOYSA-N
Formula
C25H24N4O2S
Mass
444.55
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
Phenyl-1,3-oxazoles Benzoic acids and derivatives Phenylpropanes Oxazolopyridines Benzoyl derivatives Toluenes Pyridines and derivatives Heteroaromatic compounds Thioureas Azacyclic compounds Carboxylic acids and derivatives Oxacyclic compounds Organooxygen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-acyl-phenylthiourea - Phenyl-1,3-oxazole - Benzoic acid or derivatives - 1,3-oxazolopyridine - Phenylpropane - Benzoyl - Toluene - Pyridine - Azole - Oxazole - Heteroaromatic compound - Thiourea - Carboxylic acid derivative - Oxacycle - Organoheterocyclic compound - Azacycle - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organopnictogen compound - Organic oxygen 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