Compound Identification
SMILES
CC1=CC(NC(=S)NC(NC(=O)C2=CC=CC=C2I)C(Cl)(Cl)Cl)=CC=C1
InChIKey
InChIKey=QGKJQEBDWOBCPL-UHFFFAOYSA-N
Formula
C17H15Cl3IN3OS
Mass
542.64
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- 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-phenylthioureas
Alternative Parents
2-halobenzoic acids and derivatives Benzamides Benzoyl derivatives Toluenes Iodobenzenes Aryl iodides Vinylogous halides Thioureas Secondary carboxylic acid amides Organic oxides Organochlorides Hydrocarbon derivatives Organoiodides Organonitrogen compounds Organooxygen compounds Alkyl chlorides Organopnictogen compounds
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
N-phenylthiourea - 2-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzamide - Benzoic acid or derivatives - Benzoyl - Toluene - Halobenzene - Iodobenzene - Aryl halide - Aryl iodide - Vinylogous halide - Thiourea - Secondary carboxylic acid amide - Carboxamide group - Carboxylic acid derivative - Hydrocarbon derivative - Organohalogen compound - Organopnictogen compound - Organochloride - Organoiodide - Organonitrogen compound - Organooxygen compound - Alkyl chloride - Organic oxygen compound - Organic nitrogen compound - Organosulfur compound - Organic oxide - Alkyl halide - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as n-phenylthioureas. These are compounds containing a N-phenylthiourea moiety, which is structurally characterized by a phenyl group linked to one nitrogen atom of a thiourea group.
External Descriptors
Not available