Compound Identification
SMILES
CC1=CC(C)=C(N\C=C(/C#N)C2=NC(=CS2)C2=CC=C(Cl)C=C2)C=C1
InChIKey
InChIKey=BQTHHHCXABKTNT-LFIBNONCSA-N
Formula
C20H16ClN3S
Mass
365.88
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
m-Xylenes
Alternative Parents
Aniline and substituted anilines Chlorobenzenes 2,4-disubstituted thiazoles Aryl chlorides Heteroaromatic compounds Nitriles Enamines Azacyclic compounds Organochlorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
M-xylene - Aniline or substituted anilines - 2,4-disubstituted 1,3-thiazole - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Azole - Heteroaromatic compound - Thiazole - Nitrile - Carbonitrile - Azacycle - Enamine - Organoheterocyclic compound - Organochloride - Organohalogen compound - Amine - Organic nitrogen compound - Hydrocarbon derivative - Cyanide - Organonitrogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as m-xylenes. These are aromatic compounds that contain a m-xylene moiety, which is a monocyclic benzene carrying exactly two methyl groups at the 1- and 3-positions.
External Descriptors
Not available