Compound Identification
SMILES
CCC1=CC2=C(SC3=C(S2)C=C(CC)C=C3)C=C1
InChIKey
InChIKey=WHUVYSYGNNMIBW-UHFFFAOYSA-N
Formula
C16H16S2
Mass
272.42
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Benzodithiins
-
Subclass
1,4-benzodithiins
- Level 5 Thianthrenes
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Subclass
1,4-benzodithiins
-
Class
Benzodithiins
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzodithiins
Subclass
1,4-benzodithiins
Intermediate Tree Nodes
Not available
Direct Parent
Thianthrenes
Alternative Parents
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Thianthrene - Diarylthioether - Aryl thioether - Benzenoid - Thioether - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as thianthrenes. These are organic compounds containing a thianthrene moiety. Thianthrene is a tricyclic ring system that consists of two benzene rings fused to each other through a 1,4-dithiin ring.
External Descriptors
Not available