Compound Identification
SMILES
CSC1=CC=CC(NC(=S)N(CC2=CC=CN2CC2=CC(Cl)=CC=C2)CC2=CC=CC=C2)=C1
InChIKey
InChIKey=SLUBWQJEGFWNHG-UHFFFAOYSA-N
Formula
C27H26ClN3S2
Mass
492.1
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
Thiophenol ethers Chlorobenzenes Alkylarylthioethers Substituted pyrroles Aryl chlorides Heteroaromatic compounds Thioureas Sulfenyl compounds Azacyclic compounds Organonitrogen compounds Organochlorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N-phenylthiourea - Aryl thioether - Thiophenol ether - Chlorobenzene - Halobenzene - Alkylarylthioether - Aryl halide - Aryl chloride - Substituted pyrrole - Heteroaromatic compound - Pyrrole - Thiourea - Sulfenyl compound - Azacycle - Organoheterocyclic compound - Thioether - Organohalogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organochloride - Organonitrogen compound - Organosulfur 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