Compound Identification
SMILES
CC1=C(C)C(NCCC(=O)C2=CC=CS2)=CC=C1
InChIKey
InChIKey=UMDVLDRACWDZFK-UHFFFAOYSA-N
Formula
C15H17NOS
Mass
259.37
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Xylenes
Intermediate Tree Nodes
Not available
Direct Parent
o-Xylenes
Alternative Parents
Phenylalkylamines Aryl alkyl ketones Aniline and substituted anilines Secondary alkylarylamines Beta-amino ketones Thiophenes Heteroaromatic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
O-xylene - Phenylalkylamine - Aniline or substituted anilines - Aryl alkyl ketone - Aryl ketone - Secondary aliphatic/aromatic amine - Beta-aminoketone - Heteroaromatic compound - Thiophene - Ketone - Secondary amine - Organoheterocyclic compound - Amine - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as o-xylenes. These are aromatic compounds that contain a o-xylene moiety, which is a monocyclic benzene carrying exactly two methyl groups at the 1- and 2-positions.
External Descriptors
Not available