Compound Identification
SMILES
CN1CC2CC(=O)C=C2C2=C1S(=O)(=O)C=CC(C)=C2
InChIKey
InChIKey=XXQQKEFUGCBVJD-UHFFFAOYSA-N
Formula
C14H15NO3S
Mass
277.34
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Thiepins
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Thiepins
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Thiepins
Alternative Parents
Tetrahydropyridines Sulfones Ketene acetals Cyclic ketones Azacyclic compounds Organic oxides Hydrocarbon derivatives Amines
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Tetrahydropyridine - Thiepin - Sulfone - Ketene acetal or derivatives - Ketone - Cyclic ketone - Azacycle - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Amine - Carbonyl group - Hydrocarbon derivative - Aliphatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as thiepins. These are heterocyclic compounds containing an unsaturated seven-member heterocycle, with six carbon atoms and one sulfur atom.
External Descriptors
Not available