Compound Identification
SMILES
CC1=CC(C)=C(C=C1)C1=CSC(=N1)C(=C\NC1=CC=CC=C1C)\C#N
InChIKey
InChIKey=BRVXFFWAUCDJJM-SFQUDFHCSA-N
Formula
C21H19N3S
Mass
345.46
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 Aminotoluenes Secondary alkylarylamines 2,4-disubstituted thiazoles Heteroaromatic compounds Nitriles Enamines Azacyclic compounds Organopnictogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
M-xylene - Aminotoluene - Aniline or substituted anilines - 2,4-disubstituted 1,3-thiazole - Secondary aliphatic/aromatic amine - Toluene - Azole - Heteroaromatic compound - Thiazole - Enamine - Carbonitrile - Nitrile - Secondary amine - Azacycle - Organoheterocyclic compound - Organonitrogen compound - Hydrocarbon derivative - Organopnictogen compound - Organic nitrogen compound - Amine - 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