Compound Identification
SMILES
COC1=C(NC(=S)NC(=O)CN2N=CC3=CC=CC=C23)C=CC(OC2=C3SC(=CC3=NC=C2)C2=NC=CN2C)=C1
InChIKey
InChIKey=UGWFQLSWMPVXQQ-UHFFFAOYSA-N
Formula
C28H23N7O3S2
Mass
569.66
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
Diarylethers Thienopyridines Indazoles Methoxyanilines 2,3,5-trisubstituted thiophenes Anisoles Methoxybenzenes Phenoxy compounds Alkyl aryl ethers Pyridines and derivatives N-substituted imidazoles Pyrazoles Heteroaromatic compounds Thioureas Carboxylic acids and derivatives Azacyclic compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-acyl-phenylthiourea - Diaryl ether - Benzopyrazole - Indazole - Thienopyridine - Methoxyaniline - Anisole - Phenoxy compound - Phenol ether - 2,3,5-trisubstituted thiophene - Methoxybenzene - Alkyl aryl ether - Pyridine - N-substituted imidazole - Thiophene - Pyrazole - Heteroaromatic compound - Azole - Imidazole - Thiourea - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Ether - Hydrocarbon derivative - Organic oxygen compound - Organic oxide - Organonitrogen compound - Carbonyl group - Organooxygen compound - Organosulfur compound - Organic nitrogen 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