Compound Identification
SMILES
CCCCSC1(SCCCC)N=C(N)C2(C#N)C(C3=CC(Br)=C(OC)C=C3)C12C#N
InChIKey
InChIKey=OPVQGNHEZDQPNU-UHFFFAOYSA-N
Formula
C22H27BrN4OS2
Mass
507.51
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 Alkyl aryl ethers Bromobenzenes Tetrahydropyridines Aryl bromides Imidolactams Pyrrolines Nitriles Dialkylthioethers Carboximidamides Carboxamidines Azacyclic compounds Sulfenyl compounds Propargyl-type 1,3-dipolar organic compounds Organobromides Hydrocarbon derivatives Amines
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenoxy compound - Anisole - Methoxybenzene - Alkyl aryl ether - Bromobenzene - Halobenzene - Tetrahydropyridine - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Imidolactam - Pyrroline - Amidine - Azacycle - Organoheterocyclic compound - Carboxylic acid amidine - Ether - Dialkylthioether - Carbonitrile - Nitrile - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Thioether - Sulfenyl compound - Carboximidamide - Organic nitrogen compound - Organohalogen compound - Organobromide - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Amine - Organic oxygen compound - Cyanide - Hydrocarbon derivative - Aromatic heteropolycyclic 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