Compound Identification
SMILES
O[C@H]1[C@H](SC2=C(NC1=O)C=CC(OC1=CC=CC=C1)=C2)C1=CC2=C(OCO2)C=C1
InChIKey
InChIKey=VFPCZSBNLUCBPC-LEWJYISDSA-N
Formula
C22H17NO5S
Mass
407.44
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
Diarylethers Benzodioxoles Phenoxy compounds Phenol ethers Alkylarylthioethers Secondary carboxylic acid amides Secondary alcohols Lactams Oxacyclic compounds Acetals Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organonitrogen compounds Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzothiazepine - Diaryl ether - Benzodioxole - Phenoxy compound - Aryl thioether - Phenol ether - Alkylarylthioether - Monocyclic benzene moiety - Benzenoid - Carboxamide group - Lactam - Secondary alcohol - Secondary carboxylic acid amide - Ether - Carboxylic acid derivative - Acetal - Thioether - Oxacycle - Azacycle - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Alcohol - Organic oxide - Carbonyl group - Organopnictogen compound - Organic oxygen compound - Organic nitrogen 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