Compound Identification
SMILES
CC1=C(C)C=C(NC2=NC3=NON=C3N=C2NC2CCCCC2)C=C1
InChIKey
InChIKey=NUGAYIMUBCLHFL-UHFFFAOYSA-N
Formula
C18H22N6O
Mass
338.415
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
o-Xylenes
Alternative Parents
Aniline and substituted anilines Secondary alkylarylamines Aminopyrazines Imidolactams Heteroaromatic compounds Furazans Azacyclic compounds Organopnictogen compounds Organic oxygen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
O-xylene - Aniline or substituted anilines - Aminopyrazine - Secondary aliphatic/aromatic amine - Imidolactam - Pyrazine - Azole - Furazan - Oxadiazole - Heteroaromatic compound - Azacycle - Organoheterocyclic compound - Secondary amine - Amine - Hydrocarbon derivative - Organonitrogen compound - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as o-xylenes. These are aromatic compounds that contain a o-xylene moiety, which is a monocyclic benzene carrying exactly two methyl groups at the 1- and 2-positions.
External Descriptors
Not available