Compound Identification
SMILES
CC.COC1=NC(NC2=CC=CC=C2)=NC=C1Br
InChIKey
InChIKey=OSCKBFKAOICWAD-UHFFFAOYSA-N
Formula
C13H16BrN3O
Mass
310.195
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Aniline and substituted anilines
Intermediate Tree Nodes
Not available
Direct Parent
Aniline and substituted anilines
Alternative Parents
Halopyrimidines Aminopyrimidines and derivatives Alkyl aryl ethers Aryl bromides Heteroaromatic compounds Secondary amines Azacyclic compounds Organobromides Hydrocarbon derivatives Saturated hydrocarbons
Molecular Framework
Not available
Substituents
Aniline or substituted anilines - Alkyl aryl ether - Aminopyrimidine - Halopyrimidine - Aryl bromide - Aryl halide - Pyrimidine - Heteroaromatic compound - Organoheterocyclic compound - Secondary amine - Ether - Azacycle - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Organobromide - Organohalogen compound - Amine - Organic nitrogen compound - Hydrocarbon derivative - Hydrocarbon - Saturated hydrocarbon - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as aniline and substituted anilines. These are organic compounds containing an aminobenzene moiety.
External Descriptors
Not available