Compound Identification
SMILES
ClC1=CC2=C(SC3=CC=CC=C3CN2CC2CCN(CC3=CC=CC=C3)CC2)C=C1
InChIKey
InChIKey=LLNHOYWFJYKAME-UHFFFAOYSA-N
Formula
C26H27ClN2S
Mass
435.03
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
N-benzylpiperidines Diarylthioethers Phenylmethylamines Dialkylarylamines Benzylamines Aralkylamines Aryl chlorides Trialkylamines Azacyclic compounds Organochlorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Dibenzothiazepine - N-benzylpiperidine - Benzylpiperidine - Diarylthioether - Benzylamine - Aryl thioether - Phenylmethylamine - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Aralkylamine - Aryl halide - Piperidine - Aryl chloride - Monocyclic benzene moiety - Benzenoid - Tertiary aliphatic amine - Tertiary amine - Thioether - Azacycle - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organohalogen compound - Amine - Organochloride - 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