Compound Identification
SMILES
[Br-].OC1=CC=CC(\C=C\C2=CC=[N+](CCCCCCCCCCSC3=NC=CC(=O)N3)C=C2)=C1
InChIKey
InChIKey=IEPMTAQIEGZYPY-UEIGIMKUSA-N
Formula
C27H34BrN3O2S
Mass
544.55
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Styrenes
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Styrenes
Intermediate Tree Nodes
Not available
Direct Parent
Styrenes
Alternative Parents
Pyrimidones 1-hydroxy-2-unsubstituted benzenoids 1-hydroxy-4-unsubstituted benzenoids Alkylarylthioethers Pyridinium derivatives Hydropyrimidines Heteroaromatic compounds Lactams Sulfenyl compounds Azacyclic compounds Hydrocarbon derivatives Organic bromide salts Organic oxides Organic zwitterions Organonitrogen compounds Organooxygen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Aryl thioether - Styrene - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Pyrimidone - Alkylarylthioether - Hydropyrimidine - Pyridine - Pyridinium - Pyrimidine - Heteroaromatic compound - Lactam - Azacycle - Sulfenyl compound - Thioether - Organoheterocyclic compound - Organic nitrogen compound - Organic zwitterion - Organic salt - Organic bromide salt - Hydrocarbon derivative - Organic oxide - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as styrenes. These are organic compounds containing an ethenylbenzene moiety.
External Descriptors
Not available