Compound Identification
SMILES
CCC(=O)OC1=C(SC2=CC=CC=C2N2C=CC=C12)C1=CC=CC=C1
InChIKey
InChIKey=RLBFCTJFUDQGIX-UHFFFAOYSA-N
Formula
C21H17NO2S
Mass
347.43
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
Aryl thioethers Benzene and substituted derivatives Pyrroles Heteroaromatic compounds Enol esters Thioenol ethers Monocarboxylic acids and derivatives Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzothiazepine - Aryl thioether - Monocyclic benzene moiety - Benzenoid - Enol ester - Pyrrole - Heteroaromatic compound - Carboxylic acid ester - Thioenolether - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Azacycle - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organic oxide - Carbonyl group - 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