Compound Identification
SMILES
CC(C)C1=CC(Cl)=C(C=C1)N=C(N)N=C(N)N
InChIKey
InChIKey=GSRIIZSHELGISB-UHFFFAOYSA-N
Formula
C11H16ClN5
Mass
253.73
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Cumenes
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Cumenes
Intermediate Tree Nodes
Not available
Direct Parent
Cumenes
Alternative Parents
Phenylpropanes Chlorobenzenes Biguanides Aryl chlorides Propargyl-type 1,3-dipolar organic compounds Carboximidamides Organochlorides Imines Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Cumene - Phenylpropane - Biguanide - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Guanidine - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboximidamide - Organonitrogen compound - Hydrocarbon derivative - Organic nitrogen compound - Organochloride - Imine - Organohalogen compound - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as cumenes. These are aromatic compounds containing a prop-2-ylbenzene moiety.
External Descriptors
Not available