Compound Identification
SMILES
COC1=C(C)C(OC)=C(C=C1)C1SC(CC(=O)N2CCC(CC2)C(O)=O)C(=O)N(CC(C)(C)C)C2=C1C=C(C)C=C2
InChIKey
InChIKey=HSWZWQQZVWLSRX-UHFFFAOYSA-N
Formula
C32H42N2O6S
Mass
582.76
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
Dimethoxybenzenes Piperidinecarboxylic acids N-acylpiperidines Phenoxy compounds Anisoles Toluenes Alkyl aryl ethers Tertiary carboxylic acid amides Lactams Azacyclic compounds Carboxylic acids Dialkylthioethers Monocarboxylic acids and derivatives Organonitrogen compounds Organopnictogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzothiazepine - Dimethoxybenzene - M-dimethoxybenzene - N-acyl-piperidine - Piperidinecarboxylic acid - Methoxybenzene - Phenoxy compound - Phenol ether - Anisole - Alkyl aryl ether - Toluene - Monocyclic benzene moiety - Benzenoid - Piperidine - Tertiary carboxylic acid amide - Carboxamide group - Lactam - Azacycle - Carboxylic acid derivative - Carboxylic acid - Ether - Monocarboxylic acid or derivatives - Dialkylthioether - Thioether - Organic oxide - Hydrocarbon derivative - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organopnictogen 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