Compound Identification
SMILES
CC1=C(C)C=C(C=C1)C1=NN([C@@H](C1)C1=CC=CC=C1)C1=NC(=CS1)C1=CC=CC=C1
InChIKey
InChIKey=PCJIEXUDZWQIAC-VWLOTQADSA-N
Formula
C26H23N3S
Mass
409.55
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
2,4-disubstituted thiazoles Pyrazolines Heteroaromatic compounds Hydrazones Azacyclic compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
O-xylene - 2,4-disubstituted 1,3-thiazole - Heteroaromatic compound - Thiazole - Pyrazoline - Azole - Azacycle - Organoheterocyclic compound - Hydrazone - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen 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