Compound Identification
SMILES
CC(O)C1=C(Cl)C=C(NC(=S)NC2=CC=C(C=C2)C(N)=O)C=C1
InChIKey
InChIKey=HEWYKEDZUTXDFF-UHFFFAOYSA-N
Formula
C16H16ClN3O2S
Mass
349.83
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
Benzamides Benzoyl derivatives Chlorobenzenes Aryl chlorides Thioureas Secondary alcohols Primary carboxylic acid amides Organonitrogen compounds Organochlorides Organic oxides Hydrocarbon derivatives Aromatic alcohols
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
N-phenylthiourea - Benzamide - Benzoic acid or derivatives - Benzoyl - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Carboxamide group - Thiourea - Secondary alcohol - Primary carboxylic acid amide - Carboxylic acid derivative - Organohalogen compound - Organic oxygen compound - Organic nitrogen compound - Alcohol - Aromatic alcohol - Hydrocarbon derivative - Organic oxide - Organochloride - 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