Compound Identification
SMILES
NC(CC1=CC2=C(SC[C@@H](NS(=O)(=O)CC3=CC=CC=C3)C(=O)N2CC(=O)NCC2=CC=C(C=C2)C(N)=N)C=C1)C(O)=O
InChIKey
InChIKey=ZDAIRPLLDYCTQJ-OZAIVSQSSA-N
Formula
C29H32N6O6S2
Mass
624.73
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
Alpha amino acids Alkylarylthioethers Aralkylamines Organosulfonamides Organic sulfonamides Benzene and substituted derivatives Tertiary carboxylic acid amides Aminosulfonyl compounds Tertiary amines Secondary carboxylic acid amides Amino acids Lactams Monocarboxylic acids and derivatives Carboxylic acids Azacyclic compounds Carboximidamides Carboxamidines Monoalkylamines Hydrocarbon derivatives Carbonyl compounds Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzothiazepine - Alpha-amino acid - Alpha-amino acid or derivatives - Aryl thioether - Aralkylamine - Alkylarylthioether - Monocyclic benzene moiety - Organic sulfonic acid amide - Benzenoid - Organosulfonic acid amide - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Aminosulfonyl compound - Tertiary carboxylic acid amide - Sulfonyl - Amino acid or derivatives - Amino acid - Carboxamide group - Lactam - Secondary carboxylic acid amide - Tertiary amine - Thioether - Carboximidamide - Azacycle - Carboxylic acid amidine - Amidine - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Organic nitrogen compound - Hydrocarbon derivative - Carbonyl group - Organic oxide - Amine - Primary aliphatic amine - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Primary amine - 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