Compound Identification
SMILES
CN1CCN(CC1)C(=S)CC1=CC2=C(SCC3=CC=CC=C3C2)C=C1
InChIKey
InChIKey=UIOHTKKTUBDJRF-UHFFFAOYSA-N
Formula
C21H24N2S2
Mass
368.56
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Benzothiepins
- Subclass Dibenzothiepins
-
Class
Benzothiepins
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzothiepins
Subclass
Dibenzothiepins
Intermediate Tree Nodes
Not available
Direct Parent
Dibenzothiepins
Alternative Parents
N-methylpiperazines Alkylarylthioethers Benzenoids Thioamides Trialkylamines Thiocarboxylic acid amides Azacyclic compounds Thiocarbonyl compounds Organopnictogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Dibenzothiepin - Aryl thioether - Alkylarylthioether - N-alkylpiperazine - N-methylpiperazine - Benzenoid - Piperazine - 1,4-diazinane - Thioamide - Tertiary aliphatic amine - Tertiary amine - Azacycle - Thioether - Thiocarboxylic acid amide - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Thiocarbonyl group - Organosulfur compound - Organonitrogen compound - Amine - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as dibenzothiepins. These are compounds containing a dibenzothiepin moiety, which consists of two benzene connected by a thiepine ring.
External Descriptors
Not available