Compound Identification
SMILES
COC1=CC2=C(SC3=C(CC2N2CCN(C)CC2)C=CC(F)=C3)C=C1
InChIKey
InChIKey=BDHGVPCSJFFQKK-UHFFFAOYSA-N
Formula
C20H23FN2OS
Mass
358.48
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
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 Anisoles N-methylpiperazines Aralkylamines Alkyl aryl ethers Aryl fluorides Trialkylamines Azacyclic compounds Organofluorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Dibenzothiepin - Diarylthioether - Aryl thioether - Anisole - Phenol ether - N-methylpiperazine - N-alkylpiperazine - Alkyl aryl ether - Aralkylamine - Benzenoid - Aryl fluoride - Piperazine - Aryl halide - 1,4-diazinane - Tertiary aliphatic amine - Tertiary amine - Thioether - Azacycle - Ether - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Hydrocarbon derivative - Amine - Organohalogen compound - Organofluoride - Organonitrogen 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