Compound Identification
SMILES
CCCCC1(CC)CS(=O)(=O)C2=C(C=C(OC)C=C2)[C@H]([C@H]1O)C1=CC(=CC=C1)[N+](C)(C)C
InChIKey
InChIKey=QOILSQIHLZNSQL-YFHSQZFMSA-N
Formula
C26H38NO4S
Mass
460.65
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
Anisoles Aniline and substituted anilines Alkyl aryl ethers Sulfones Secondary alcohols Organic oxides Hydrocarbon derivatives Amines Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzothiepin - Anisole - Phenol ether - Aniline or substituted anilines - Alkyl aryl ether - Benzenoid - Monocyclic benzene moiety - Sulfone - Secondary alcohol - Ether - Amine - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Alcohol - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic cation - 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