Compound Identification
SMILES
CC1=CC(C)(C)NC(=S)N1C1=C(Cl)C=CC(Cl)=C1
InChIKey
InChIKey=LRIAPYAQRQUNHL-UHFFFAOYSA-N
Formula
C13H14Cl2N2S
Mass
301.23
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
Dichlorobenzenes Pyrimidinethiones 2-Thiopyrimidines Hydropyrimidines Aryl chlorides Thioureas Azacyclic compounds Organonitrogen compounds Organochlorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N-phenylthiourea - 1,4-dichlorobenzene - 2-thiopyrimidine - Thiopyrimidine - Chlorobenzene - Pyrimidinethione - Halobenzene - Aryl chloride - Aryl halide - Pyrimidine - Hydropyrimidine - 1,2,3,4-tetrahydropyrimidine - Thiourea - Azacycle - Organoheterocyclic compound - Organonitrogen compound - Organosulfur compound - Organic nitrogen compound - Hydrocarbon derivative - Organochloride - Organohalogen compound - Aromatic heteromonocyclic 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