Compound Identification
SMILES
CC1=CC(CN2C=CC=C2C=NNC(=S)NC2=C(C)C(Cl)=CC=C2)=C(C)C=C1
InChIKey
InChIKey=MPYPXULGLLOBRE-UHFFFAOYSA-N
Formula
C22H23ClN4S
Mass
410.96
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
p-Xylenes
Alternative Parents
Toluenes Chlorobenzenes Thiosemicarbazones Substituted pyrroles Aryl chlorides Heteroaromatic compounds Azacyclic compounds Organosulfur compounds Organochlorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
P-xylene - Chlorobenzene - Halobenzene - Toluene - Aryl chloride - Aryl halide - Substituted pyrrole - Thiosemicarbazone - Heteroaromatic compound - Pyrrole - Azacycle - Organoheterocyclic compound - Organosulfur compound - Organonitrogen compound - Organochloride - Organohalogen compound - Hydrocarbon derivative - Organic nitrogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as p-xylenes. These are aromatic compounds that contain a p-xylene moiety, which is a monocyclic benzene carrying exactly two methyl groups at the 1- and 4-positions.
External Descriptors
Not available