Compound Identification
SMILES
COC1=CC(OC)=C(NC(=O)C2(C)CSC3=CC=CC=C3C(=O)N2CC2=CN=CC=C2)C=C1
InChIKey
InChIKey=UWHAUYJQSURPEF-UHFFFAOYSA-N
Formula
C25H25N3O4S
Mass
463.55
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 Alpha amino acids and derivatives Methoxyanilines Anilides Phenoxy compounds N-arylamides Anisoles Alkyl aryl ethers Alkylarylthioethers Vinylogous thioesters Pyridines and derivatives Tertiary carboxylic acid amides Heteroaromatic compounds Secondary carboxylic acid amides Lactams Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzothiazepine - Dimethoxybenzene - Alpha-amino acid or derivatives - M-dimethoxybenzene - Anilide - Methoxyaniline - N-arylamide - Phenoxy compound - Aryl thioether - Anisole - Methoxybenzene - Phenol ether - Alkylarylthioether - Alkyl aryl ether - Pyridine - Benzenoid - Monocyclic benzene moiety - Vinylogous thioester - Heteroaromatic compound - Tertiary carboxylic acid amide - Carboxamide group - Secondary carboxylic acid amide - Lactam - Azacycle - Thioether - Carboxylic acid derivative - Ether - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organonitrogen 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