Compound Identification
SMILES
C[C@H](S[C@H]1CC2=C(SC3=CC=CC=C13)C=CC(Cl)=C2)C(N)=O
InChIKey
InChIKey=HJURBEHONKUNEP-QFYYESIMSA-N
Formula
C17H16ClNOS2
Mass
349.89
Taxonomic Classification
Taxonomy Tree
-
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 Benzenoids Aryl chlorides Primary carboxylic acid amides Sulfenyl compounds Dialkylthioethers Organopnictogen compounds Organonitrogen compounds Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Dibenzothiepin - Diarylthioether - Aryl thioether - Aryl chloride - Aryl halide - Benzenoid - Carboxamide group - Primary carboxylic acid amide - Sulfenyl compound - Thioether - Carboxylic acid derivative - Dialkylthioether - Organic oxide - Organic nitrogen compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Organopnictogen compound - Carbonyl group - 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