Compound Identification
SMILES
CC1=CC(Cl)=C(NC(=O)CN2C3=C(SC4=CC=CC=C4C2=O)C=CC(=C3)C(=O)N2CCOCC2)C=C1
InChIKey
InChIKey=UZKXRCOFZSIJNP-UHFFFAOYSA-N
Formula
C27H24ClN3O4S
Mass
522.02
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Benzothiazepines
- Subclass Dibenzothiazepines
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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
Diarylthioethers Alpha amino acids and derivatives Anilides Morpholine carboxylic acids and derivatives N-arylamides Toluenes Chlorobenzenes Vinylogous thioesters Aryl chlorides Tertiary carboxylic acid amides Secondary carboxylic acid amides Lactams Oxacyclic compounds Dialkyl ethers Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organochlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Dibenzothiazepine - Diarylthioether - Alpha-amino acid or derivatives - Morpholine-4-carboxylic acid or derivatives - Anilide - N-arylamide - Aryl thioether - Chlorobenzene - Toluene - Halobenzene - Morpholine - Vinylogous thioester - Oxazinane - Aryl chloride - Benzenoid - Monocyclic benzene moiety - Aryl halide - Tertiary carboxylic acid amide - Lactam - Secondary carboxylic acid amide - Carboxamide group - Oxacycle - Carboxylic acid derivative - Azacycle - Dialkyl ether - Thioether - Ether - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Carbonyl group - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - 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