Compound Identification
SMILES
CC1=CC=CC=C1CS\C(NC1=CC(C)=C(C)C=C1)=C(/C#N)C(=O)NCC1=CC=CO1
InChIKey
InChIKey=UFNRLKLKXWVGBU-WJTDDFOZSA-N
Formula
C25H25N3O2S
Mass
431.55
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
Toluenes Vinylogous thioesters Vinylogous amides Heteroaromatic compounds Furans Secondary carboxylic acid amides Ketene acetals Sulfenyl compounds Oxacyclic compounds Nitriles Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
O-xylene - Toluene - Vinylogous thioester - Furan - Vinylogous amide - Heteroaromatic compound - Carboxamide group - Ketene acetal or derivatives - Secondary carboxylic acid amide - Oxacycle - Carboxylic acid derivative - Organoheterocyclic compound - Sulfenyl compound - Carbonitrile - Nitrile - Organic oxide - Organooxygen compound - Organonitrogen compound - Organosulfur compound - Organic nitrogen compound - Carbonyl group - Organic oxygen compound - Hydrocarbon derivative - Cyanide - 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