Compound Identification
SMILES
CC1=C(NC(=S)NCCSCCO)C=CC(Cl)=C1
InChIKey
InChIKey=WJFRKAMFWSKAGF-UHFFFAOYSA-N
Formula
C12H17ClN2OS2
Mass
304.85
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
Toluenes Chlorobenzenes Aryl chlorides Thioureas Sulfenyl compounds Dialkylthioethers Primary alcohols Organonitrogen compounds Organochlorides Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
N-phenylthiourea - Chlorobenzene - Halobenzene - Toluene - Aryl chloride - Aryl halide - Thiourea - Sulfenyl compound - Thioether - Dialkylthioether - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Organic nitrogen compound - Alcohol - Organosulfur compound - Primary alcohol - Hydrocarbon derivative - 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