Compound Identification
SMILES
CSC1=CC2=C(SC3=CC=CC=C3CC2N2CCN(CCCN3C(=O)NC4=CC=CC=C34)CC2)C=C1
InChIKey
InChIKey=RBPPCIAYANXQFT-UHFFFAOYSA-N
Formula
C29H32N4OS2
Mass
516.72
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
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Class
Benzothiepins
- Subclass Dibenzothiepins
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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 Benzimidazoles Thiophenol ethers N-alkylpiperazines Aralkylamines Alkylarylthioethers N-substituted imidazoles Heteroaromatic compounds Ureas Trialkylamines Sulfenyl compounds Azacyclic compounds Organooxygen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Dibenzothiepin - Diarylthioether - Benzimidazole - Aryl thioether - Thiophenol ether - N-alkylpiperazine - Alkylarylthioether - Aralkylamine - 1,4-diazinane - N-substituted imidazole - Piperazine - Benzenoid - Azole - Heteroaromatic compound - Imidazole - Urea - Tertiary aliphatic amine - Tertiary amine - Sulfenyl compound - Azacycle - Thioether - Organic oxide - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Amine - Hydrocarbon derivative - Organic nitrogen compound - Organosulfur compound - 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