Compound Identification
SMILES
BrC1=CC(CSC2=CC=CC=C2C2=NCCCN2)=C(OC2CCCC2)C=C1
InChIKey
InChIKey=PUDQPIKMLRFZPN-UHFFFAOYSA-N
Formula
C22H25BrN2OS
Mass
445.42
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
- Class Phenol ethers
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Phenol ethers
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Phenol ethers
Alternative Parents
Thiophenol ethers Phenoxy compounds Alkyl aryl ethers Alkylarylthioethers Bromobenzenes Aryl bromides Imidolactams Hydropyrimidines Sulfenyl compounds Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Carboximidamides Carboxamidines Hydrocarbon derivatives Organobromides Amines
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenoxy compound - Aryl thioether - Phenol ether - Thiophenol ether - Alkyl aryl ether - Bromobenzene - Alkylarylthioether - Halobenzene - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Imidolactam - Hydropyrimidine - 1,4,5,6-tetrahydropyrimidine - Amidine - Azacycle - Organoheterocyclic compound - Carboxylic acid amidine - Ether - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Sulfenyl compound - Carboximidamide - Thioether - Hydrocarbon derivative - Organic nitrogen compound - Amine - Organohalogen compound - Organobromide - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic oxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenol ethers. These are aromatic compounds containing an ether group substituted with a benzene ring.
External Descriptors
Not available