Compound Identification
SMILES
OCCC1=CC=C(S1)C1(CC2C3=CC=CC=C3C1C1=CC=CC=[N+]21)C1=CC=CS1
InChIKey
InChIKey=IZEPCKLRFRANHV-UHFFFAOYSA-N
Formula
C25H22NOS2
Mass
416.58
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
- Class Tetralins
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Tetralins
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Tetralins
Alternative Parents
2,5-disubstituted thiophenes Pyridinium derivatives Heteroaromatic compounds Azacyclic compounds Primary alcohols Organonitrogen compounds Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Tetralin - 2,5-disubstituted thiophene - Pyridine - Pyridinium - Heteroaromatic compound - Thiophene - Azacycle - Organoheterocyclic compound - Alcohol - Hydrocarbon derivative - Organic oxygen compound - Organic nitrogen compound - Primary alcohol - Organooxygen compound - Organonitrogen compound - Organic cation - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as tetralins. These are polycyclic aromatic compounds containing a tetralin moiety, which consists of a benzene fused to a cyclohexane.
External Descriptors
Not available