Compound Identification
SMILES
COCCNCCCOC1=CC=CC(NC2=NC=C(C)C(=N2)C2=C(C(C#N)=C(SC)S2)C2=CN=CC=C2)=C1
InChIKey
InChIKey=OOCZYTIJBVDJRJ-UHFFFAOYSA-N
Formula
C28H30N6O2S2
Mass
546.71
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 Aniline and substituted anilines Aminopyrimidines and derivatives Alkylarylthioethers Alkyl aryl ethers Pyridines and derivatives Thiophenes Heteroaromatic compounds Sulfenyl compounds Nitriles Dialkylamines Dialkyl ethers Azacyclic compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenoxy compound - Aryl thioether - Phenol ether - Aniline or substituted anilines - Alkyl aryl ether - Aminopyrimidine - Alkylarylthioether - Monocyclic benzene moiety - Pyridine - Pyrimidine - Thiophene - Heteroaromatic compound - Azacycle - Sulfenyl compound - Thioether - Secondary amine - Organoheterocyclic compound - Dialkyl ether - Secondary aliphatic amine - Ether - Carbonitrile - Nitrile - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Cyanide - Organic nitrogen compound - Amine - 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