Compound Identification
SMILES
CC(C)C1=CC(OCCNCC2=CC=CS2)=CC=C1
InChIKey
InChIKey=RKODOOUPMNXDSL-UHFFFAOYSA-N
Formula
C16H21NOS
Mass
275.41
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 Aralkylamines Alkyl aryl ethers Thiophenes Heteroaromatic compounds Dialkylamines Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Cumene - Phenylpropane - Phenoxy compound - Phenol ether - Alkyl aryl ether - Aralkylamine - Thiophene - Heteroaromatic compound - Organoheterocyclic compound - Secondary amine - Ether - Secondary aliphatic amine - Hydrocarbon derivative - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Amine - Aromatic heteromonocyclic 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