Compound Identification
SMILES
CC1=CC=C(C=C1)S(=O)(=O)NN=C1CCCSC2=CC=CC=C12
InChIKey
InChIKey=XQSCAKIDVDBNCK-UHFFFAOYSA-N
Formula
C17H18N2O2S2
Mass
346.46
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Benzothiepins
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzothiepins
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Benzothiepins
Alternative Parents
Tosyl compounds Benzenesulfonamides Benzenesulfonyl compounds Alkylarylthioethers Sulfonohydrazides Hydrazinosulfonyl compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzothiepin - Benzenesulfonamide - Tosyl compound - Benzenesulfonyl group - Aryl thioether - Alkylarylthioether - Toluene - Monocyclic benzene moiety - Benzenoid - Hydrazinosulfonyl compound - Sulfonohydrazide - Organic sulfonic acid or derivatives - Sulfonyl - Organosulfonic acid or derivatives - Thioether - Organic nitrogen compound - Hydrocarbon derivative - Organosulfur compound - Organonitrogen compound - Organic oxide - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzothiepins. These are organic compounds containing a benzene fused to a thiepine ring (a seven-membered ring with six carbon atoms and one sulfur atom).
External Descriptors
Not available