Compound Identification
SMILES
COC1=C(C=CC(=C1)C(=O)N1CCCSC2=CC=CC=C12)C(=O)NC1=CC=CC2=C1N=C(C)N2C(=O)OC(C)(C)C
InChIKey
InChIKey=FYYJBCHQAFDNMS-UHFFFAOYSA-N
Formula
C31H32N4O5S
Mass
572.68
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
Benzamides Benzimidazoles Phenoxy compounds Anisoles Methoxybenzenes Benzoyl derivatives Alkyl aryl ethers Alkylarylthioethers Carbonylimidazoles N-substituted imidazoles Tertiary carboxylic acid amides Heteroaromatic compounds Secondary carboxylic acid amides Azacyclic compounds Organic oxides Organonitrogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzothiazepine - Benzamide - Benzimidazole - Benzoic acid or derivatives - Anisole - Phenoxy compound - Aryl thioether - Benzoyl - Phenol ether - Methoxybenzene - Alkylarylthioether - Alkyl aryl ether - Imidazole-1-carbonyl group - Benzenoid - Monocyclic benzene moiety - N-substituted imidazole - Heteroaromatic compound - Tertiary carboxylic acid amide - Azole - Imidazole - Secondary carboxylic acid amide - Carboxamide group - Ether - Azacycle - Thioether - Carboxylic acid derivative - Organonitrogen compound - Organic oxygen compound - Organooxygen compound - Organic nitrogen compound - Organic oxide - 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