Compound Identification
SMILES
CC1=CC2=NC(CSC3=NN=C(NC(=O)NC4=CC(Cl)=C(C)C=C4)S3)=CC(=O)N2O1
InChIKey
InChIKey=QBMAMHWOBLGPHC-UHFFFAOYSA-N
Formula
C18H15ClN6O3S2
Mass
462.93
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass N-phenylureas
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
N-phenylureas
Intermediate Tree Nodes
Not available
Direct Parent
N-phenylureas
Alternative Parents
1,3,4-thiadiazol-2-ylureas Toluenes Pyrimidones Alkylarylthioethers Chlorobenzenes Aryl chlorides Heteroaromatic compounds Isoxazoles Ureas Lactams Sulfenyl compounds Oxacyclic compounds Azacyclic compounds Carbonyl compounds Organonitrogen compounds Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-phenylurea - 1,3,4-thiadiazol-2-ylurea - Aryl thioether - Chlorobenzene - Halobenzene - Alkylarylthioether - Pyrimidone - Toluene - Aryl chloride - Aryl halide - Pyrimidine - Azole - Heteroaromatic compound - Isoxazole - Thiadiazole - Lactam - Urea - Sulfenyl compound - Organoheterocyclic compound - Azacycle - Oxacycle - Thioether - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as n-phenylureas. These are compounds containing a N-phenylurea moiety, which is structurally characterized by a phenyl group linked to one nitrogen atom of a urea group.
External Descriptors
Not available