Compound Identification
SMILES
CCN1C2=C(C=CC(=C2)C(=O)NCC2=CC=CS2)[S@](=O)C2=CC=CC=C2C1=O
InChIKey
InChIKey=XFMBBISWEHEDEB-MUUNZHRXSA-N
Formula
C21H18N2O3S2
Mass
410.51
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Benzothiazepines
- Subclass Dibenzothiazepines
-
Class
Benzothiazepines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzothiazepines
Subclass
Dibenzothiazepines
Intermediate Tree Nodes
Not available
Direct Parent
Dibenzothiazepines
Alternative Parents
Benzenoids Thiophenes Tertiary carboxylic acid amides Heteroaromatic compounds Sulfoxides Secondary carboxylic acid amides Lactams Sulfinyl compounds Azacyclic compounds Organooxygen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Dibenzothiazepine - Benzenoid - Tertiary carboxylic acid amide - Thiophene - Heteroaromatic compound - Carboxamide group - Lactam - Secondary carboxylic acid amide - Sulfoxide - Carboxylic acid derivative - Sulfinyl compound - Azacycle - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Organic oxide - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as dibenzothiazepines. These are compounds containing a dibenzothiazepine moiety, which consists of two benzene connected by a thiazepine ring.
External Descriptors
Not available