Compound Identification
SMILES
CCCCCC(=O)O[C@@H]1[C@@H](SC2=CC=CC=C2N(C(=O)CCCCC)C1=O)C1=CSC=C1
InChIKey
InChIKey=ABWGFHHOJBFDJV-RPWUZVMVSA-N
Formula
C25H31NO4S2
Mass
473.65
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
Fatty acid esters Alkylarylthioethers N-substituted carboxylic acid imides Benzenoids Thiophenes Heteroaromatic compounds Dicarboximides Carboxylic acid esters Monocarboxylic acids and derivatives Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzothiazepine - Aryl thioether - Fatty acid ester - Alkylarylthioether - Carboxylic acid imide, n-substituted - Benzenoid - Fatty acyl - Carboxylic acid imide - Dicarboximide - Thiophene - Heteroaromatic compound - Carboxylic acid ester - Thioether - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Azacycle - Organooxygen compound - Organonitrogen compound - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - 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