Compound Identification
SMILES
COC1=CC=C(CSC2=NC(=O)C(C)=C(CC3=CC=CC=C3Br)N2)C=C1
InChIKey
InChIKey=WQCJXNHSDUONRF-UHFFFAOYSA-N
Formula
C20H19BrN2O2S
Mass
431.35
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Phenol ethers
- Subclass Anisoles
-
Class
Phenol ethers
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Phenol ethers
Subclass
Anisoles
Intermediate Tree Nodes
Not available
Direct Parent
Anisoles
Alternative Parents
Methoxybenzenes Phenoxy compounds Pyrimidones Alkylarylthioethers Alkyl aryl ethers Bromobenzenes Hydropyrimidines Aryl bromides Heteroaromatic compounds Vinylogous amides Azacyclic compounds Sulfenyl compounds Organonitrogen compounds Organobromides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenoxy compound - Aryl thioether - Anisole - Methoxybenzene - Alkyl aryl ether - Bromobenzene - Halobenzene - Pyrimidone - Alkylarylthioether - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Hydropyrimidine - Pyrimidine - Heteroaromatic compound - Vinylogous amide - Organoheterocyclic compound - Azacycle - Sulfenyl compound - Thioether - Ether - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organohalogen compound - Organic oxide - Organobromide - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as anisoles. These are organic compounds containing a methoxybenzene or a derivative thereof.
External Descriptors
Not available