Compound Identification
SMILES
BrC1=CC=C(OCCOC2=CC=C(C=C3C(=O)N=C4SC=C(N4C3=N)C3=CC=CC=C3)C=C2)C=C1
InChIKey
InChIKey=IFRHVPWXKOBWBJ-UHFFFAOYSA-N
Formula
C27H20BrN3O3S
Mass
546.44
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
Phenoxy compounds Alkyl aryl ethers Bromobenzenes Pyrimidones Aryl bromides Hydropyrimidines Imidolactams Thiazolines Thiazoles N-acylimines Isothioureas Azacyclic compounds Carboxylic acids and derivatives Carboximidamides Carboxamidines Propargyl-type 1,3-dipolar organic compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides Organobromides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenoxy compound - Phenol ether - Alkyl aryl ether - Pyrimidone - Halobenzene - Bromobenzene - Aryl bromide - Pyrimidine - Aryl halide - 1,4,5,6-tetrahydropyrimidine - Monocyclic benzene moiety - Imidolactam - Hydropyrimidine - Thiazole - Meta-thiazoline - N-acylimine - Isothiourea - Amidine - Azacycle - Carboxylic acid amidine - Carboxylic acid derivative - Ether - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboximidamide - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - Carbonyl group - Organohalogen compound - Organobromide - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic 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