Compound Identification
SMILES
OC(=O)CN1C=CCSC2=CC=CC=C12
InChIKey
InChIKey=DXOKUADYAGBKFU-UHFFFAOYSA-N
Formula
C11H11NO2S
Mass
221.27
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
Alpha amino acids Tertiary alkylarylamines Alkylarylthioethers Benzenoids Amino acids Monocarboxylic acids and derivatives Enamines Carboxylic acids Azacyclic compounds Allylamines Organopnictogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzothiazepine - Alpha-amino acid - Alpha-amino acid or derivatives - Aryl thioether - Tertiary aliphatic/aromatic amine - Alkylarylthioether - Benzenoid - Amino acid or derivatives - Tertiary amine - Amino acid - Allylamine - Thioether - Enamine - Monocarboxylic acid or derivatives - Carboxylic acid - Azacycle - Carboxylic acid derivative - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organopnictogen compound - Amine - Organic oxygen 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