Compound Identification
SMILES
CC1=CC2=C(NC(=CC3(S2)C(=O)NC2=CC=CC=C32)C2=CC(F)=CC=C2)C=C1
InChIKey
InChIKey=FJTXYZZGMYXMAQ-UHFFFAOYSA-N
Formula
C23H17FN2OS
Mass
388.46
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
Indolines Secondary alkylarylamines Fluorobenzenes Alkylarylthioethers Aryl fluorides Secondary carboxylic acid amides Lactams Amino acids and derivatives Enamines Azacyclic compounds Organopnictogen compounds Organofluorides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzothiazepine - Indole or derivatives - Dihydroindole - Aryl thioether - Fluorobenzene - Halobenzene - Alkylarylthioether - Secondary aliphatic/aromatic amine - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Amino acid or derivatives - Carboxamide group - Secondary carboxylic acid amide - Lactam - Secondary amine - Carboxylic acid derivative - Enamine - Thioether - Azacycle - Organohalogen compound - Hydrocarbon derivative - Organic nitrogen compound - Amine - Carbonyl group - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organofluoride - Organonitrogen compound - Organooxygen 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