Compound Identification
SMILES
COC1=CC=C(C=C1)C1=CC(NC(Br)(N1)SCC=C)C1=CC=CC=C1Cl
InChIKey
InChIKey=CPTFBXUFESZYKD-UHFFFAOYSA-N
Formula
C20H20BrClN2OS
Mass
451.81
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
Phenoxy compounds Methoxybenzenes Chlorobenzenes Alkyl aryl ethers Hydropyrimidines Aryl chlorides Allyl sulfur compounds Sulfenyl compounds Secondary amines Dialkylthioethers Azacyclic compounds Organochlorides Organobromides Hydrocarbon derivatives Alkyl bromides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenoxy compound - Anisole - Methoxybenzene - Alkyl aryl ether - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Hydropyrimidine - 1,2,3,4-tetrahydropyrimidine - Allyl sulfur compound - Azacycle - Organoheterocyclic compound - Dialkylthioether - Ether - Sulfenyl compound - Thioether - Secondary amine - Organic oxygen compound - Amine - Alkyl halide - Alkyl bromide - Organic nitrogen compound - Hydrocarbon derivative - Organohalogen compound - Organobromide - Organochloride - 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