Compound Identification
SMILES
C[C@H]1CCN(C(=O)COC(=O)C2=CC=C(C=C2)S(=O)(=O)NC2CC2)C2=CC=CC=C2S1
InChIKey
InChIKey=MILZSRUFZUQPJC-HNNXBMFYSA-N
Formula
C22H24N2O5S2
Mass
460.56
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
Benzoic acid esters Benzenesulfonamides Benzenesulfonyl compounds Benzoyl derivatives Alkylarylthioethers Organosulfonamides Tertiary carboxylic acid amides Aminosulfonyl compounds Tertiary amines Carboxylic acid esters Amino acids and derivatives Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzothiazepine - Benzenesulfonamide - Benzoate ester - Benzoic acid or derivatives - Benzenesulfonyl group - Aryl thioether - Benzoyl - Alkylarylthioether - Monocyclic benzene moiety - Organosulfonic acid amide - Benzenoid - Tertiary carboxylic acid amide - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Aminosulfonyl compound - Tertiary amine - Amino acid or derivatives - Carboxamide group - Carboxylic acid ester - Thioether - Azacycle - Carboxylic acid derivative - Carbonyl group - Organosulfur compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Amine - Organooxygen compound - Organonitrogen compound - 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