Compound Identification
SMILES
COCCCCNCCSSCCNCCCCOC1=CC=CC=C1C(C)C
InChIKey
InChIKey=RLHUNCVGJJVQRR-UHFFFAOYSA-N
Formula
C22H40N2O2S2
Mass
428.69
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Cumenes
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Cumenes
Intermediate Tree Nodes
Not available
Direct Parent
Cumenes
Alternative Parents
Phenylpropanes Phenoxy compounds Phenol ethers Alkyl aryl ethers Dialkyldisulfides Sulfenyl compounds Dialkylamines Dialkyl ethers Organopnictogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Cumene - Phenylpropane - Phenoxy compound - Phenol ether - Alkyl aryl ether - Organic disulfide - Dialkyldisulfide - Dialkyl ether - Secondary aliphatic amine - Ether - Sulfenyl compound - Secondary amine - Organonitrogen compound - Organopnictogen compound - Amine - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Organic oxygen compound - Organic nitrogen compound - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as cumenes. These are aromatic compounds containing a prop-2-ylbenzene moiety.
External Descriptors
Not available