Compound Identification
SMILES
CCCC[C@]1(CC)CS(=O)(=O)C2=C(C=CC(SC)=C2)[C@@H](N1)C1=CC=CC=C1
InChIKey
InChIKey=PDQUWKCYHZWGRR-FCHUYYIVSA-N
Formula
C22H29NO2S2
Mass
403.6
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Benzothiazepines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzothiazepines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Benzothiazepines
Alternative Parents
Thiophenol ethers Aralkylamines Alkylarylthioethers Benzene and substituted derivatives Sulfones Sulfenyl compounds Dialkylamines Azacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzothiazepine - Aryl thioether - Thiophenol ether - Aralkylamine - Alkylarylthioether - Monocyclic benzene moiety - Benzenoid - Sulfone - Secondary aliphatic amine - Secondary amine - Thioether - Sulfenyl compound - Azacycle - Organosulfur compound - Organonitrogen compound - Organic oxide - Organic nitrogen compound - Hydrocarbon derivative - Organic oxygen compound - Amine - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzothiazepines. These are organic compounds containing a benzene fused to a thiazepine ring (a seven-membered ring with a nitrogen atom and a sulfur atom replacing two carbon atoms).
External Descriptors
Not available