Compound Identification
SMILES
CC1=C(Cl)C=C(NC(=S)N(CCC2=CN=CN2CC2=CC=C(C=C2)C#N)CC2=C(Cl)C(Cl)=CC=C2)C=C1
InChIKey
InChIKey=CORBLFPDQNBFQN-UHFFFAOYSA-N
Formula
C28H24Cl3N5S
Mass
568.95
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 Benzonitriles Toluenes N-substituted imidazoles Aryl chlorides Heteroaromatic compounds Thioureas Nitriles Azacyclic compounds Organochlorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N-phenylthiourea - Benzonitrile - 1,2-dichlorobenzene - Chlorobenzene - Halobenzene - Toluene - Aryl halide - N-substituted imidazole - Aryl chloride - Heteroaromatic compound - Azole - Imidazole - Thiourea - Azacycle - Organoheterocyclic compound - Nitrile - Carbonitrile - Organosulfur compound - Hydrocarbon derivative - Cyanide - Organic nitrogen compound - Organohalogen compound - Organochloride - Organonitrogen 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