Compound Identification
SMILES
CCCCCC(=O)NC(NC(=S)NC1=CC=C(C=C1)C(O)=O)C(Cl)(Cl)Cl
InChIKey
InChIKey=KLNHXRXDHYCJIA-UHFFFAOYSA-N
Formula
C16H20Cl3N3O3S
Mass
440.76
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass N-phenylthioureas
-
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
Benzoic acids Benzoyl derivatives N-acyl amines Thioureas Secondary carboxylic acid amides Carboxylic acids Organonitrogen compounds Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds Alkyl chlorides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
N-phenylthiourea - Benzoic acid or derivatives - Benzoic acid - Benzoyl - Fatty amide - Fatty acyl - N-acyl-amine - Carboxamide group - Thiourea - Secondary carboxylic acid amide - Carboxylic acid - Carboxylic acid derivative - Organochloride - Organohalogen compound - Alkyl halide - Hydrocarbon derivative - Alkyl chloride - Carbonyl group - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - 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