Compound Identification
SMILES
CC(C)CSC1=CC2=C(SC3=CC=CC=C3CC2N2CCN(CCCO)CC2)C=C1
InChIKey
InChIKey=VVHXTOXEJVIHOT-UHFFFAOYSA-N
Formula
C25H34N2OS2
Mass
442.68
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
Diarylthioethers Thiophenol ethers N-alkylpiperazines Aralkylamines Alkylarylthioethers 1,3-aminoalcohols Trialkylamines Sulfenyl compounds Azacyclic compounds Primary alcohols Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Dibenzothiepin - Diarylthioether - Aryl thioether - Thiophenol ether - N-alkylpiperazine - Alkylarylthioether - Aralkylamine - 1,4-diazinane - Piperazine - Benzenoid - 1,3-aminoalcohol - Tertiary aliphatic amine - Tertiary amine - Sulfenyl compound - Thioether - Azacycle - Alkanolamine - Alcohol - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Primary alcohol - Amine - Organic oxygen compound - Hydrocarbon derivative - 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