Compound Identification
SMILES
CCN(CC)C1=NC(C)=NC2=C1SC(=O)N2C1=C(Br)C=C(C=C1)C(C)C
InChIKey
InChIKey=XSFIRVNENJWCEX-UHFFFAOYSA-N
Formula
C19H23BrN4OS
Mass
435.38
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 Dialkylarylamines Bromobenzenes Aminopyrimidines and derivatives Imidolactams Aryl bromides Thiazoles Heteroaromatic compounds Azacyclic compounds Organooxygen compounds Organobromides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cumene - Phenylpropane - Dialkylarylamine - Aminopyrimidine - Bromobenzene - Halobenzene - Imidolactam - Pyrimidine - Aryl bromide - Aryl halide - Heteroaromatic compound - Thiazole - Azole - Organoheterocyclic compound - Azacycle - Hydrocarbon derivative - Organohalogen compound - Organic nitrogen compound - Amine - Organobromide - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Organic oxide - Aromatic heteropolycyclic 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