Compound Identification
SMILES
CC1=CC=C(C=C1)S(O)(=O)=O.CC1(C)N=C(N)N=C(N)N1C1=CC(Cl)=C(CCNC(=O)NC2=CC=C(C=C2)S(F)(=O)=O)C=C1
InChIKey
InChIKey=FCPHNKGRHNEZOT-UHFFFAOYSA-N
Formula
C27H31ClFN7O6S2
Mass
668.16
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
Benzenesulfonyl compounds Chlorobenzenes Aminotriazines Aryl chlorides 1,3,5-triazines Sulfonyls Sulfonyl fluorides Organosulfonic acids and derivatives Ureas Guanidines Propargyl-type 1,3-dipolar organic compounds Carboximidamides Azacyclic compounds Organopnictogen compounds Organochlorides Organic oxides Imines Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Not available
Substituents
N-phenylurea - Benzenesulfonyl group - Halobenzene - Chlorobenzene - Aminotriazine - 1,3,5-triazine - Triazine - Aryl halide - Aryl chloride - Sulfonyl - Sulfonyl halide - Sulfonyl fluoride - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Urea - Carbonic acid derivative - Guanidine - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboximidamide - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Imine - Carbonyl group - Aromatic heteromonocyclic 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