Compound Identification
SMILES
CC(C1=NN2NC(=C(Cl)C2=N1)C1(C)CCCCC1)C1=C(C)C=CC(C)=C1
InChIKey
InChIKey=LJTGEJHJXNUMDD-UHFFFAOYSA-N
Formula
C21H27ClN4
Mass
370.93
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Xylenes
Intermediate Tree Nodes
Not available
Direct Parent
p-Xylenes
Alternative Parents
Aryl chlorides Triazoles Pyrazoles Heteroaromatic compounds Azacyclic compounds Organonitrogen compounds Organochlorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
P-xylene - Aryl halide - Aryl chloride - Heteroaromatic compound - 1,2,4-triazole - Pyrazole - Azole - Azacycle - Organoheterocyclic compound - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Organochloride - Organohalogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as p-xylenes. These are aromatic compounds that contain a p-xylene moiety, which is a monocyclic benzene carrying exactly two methyl groups at the 1- and 4-positions.
External Descriptors
Not available