Compound Identification
SMILES
CC(C)C1=CC=C(C=CC(=O)NC(=S)NC2=C(C=C(I)C=C2)C2=NC3=CC=CC=C3S2)C=C1
InChIKey
InChIKey=CMOWPHGAPKVDSU-UHFFFAOYSA-N
Formula
C26H22IN3OS2
Mass
583.51
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
Cinnamic acids and derivatives Aromatic monoterpenoids Bicyclic monoterpenoids Phenylpropanes Benzothiazoles Cumenes Styrenes Iodobenzenes Aryl iodides Thiazoles Heteroaromatic compounds Thioureas Azacyclic compounds Carboxylic acids and derivatives Carbonyl compounds Hydrocarbon derivatives Organic oxides Organoiodides Organonitrogen compounds Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-acyl-phenylthiourea - Cinnamic acid or derivatives - P-cymene - Aromatic monoterpenoid - Monoterpenoid - Bicyclic monoterpenoid - Cumene - 1,3-benzothiazole - Phenylpropane - Styrene - Halobenzene - Iodobenzene - Aryl iodide - Aryl halide - Heteroaromatic compound - Azole - Thiazole - Thiourea - Organoheterocyclic compound - Azacycle - Carboxylic acid derivative - Organic nitrogen compound - Organohalogen compound - Organoiodide - Organonitrogen compound - Carbonyl group - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Organic oxide - 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