Compound Identification
SMILES
CCOP(=O)(CC1=CC=C(NC(=O)[C@H]2CC3=C(C=C(C)C=C3)C(=O)[C@H](C)S2)C=C1)OCC
InChIKey
InChIKey=JVTUHZIWJOWRCZ-HTAPYJJXSA-N
Formula
C24H30NO5PS
Mass
475.54
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
Anilides N-arylamides Aryl alkyl ketones Dialkyl alkylphosphonates Phosphonic acid esters Secondary carboxylic acid amides Dialkylthioethers Organophosphorus compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzothiepin - Anilide - N-arylamide - Aryl alkyl ketone - Aryl ketone - Dialkyl alkylphosphonate - Phosphonic acid diester - Monocyclic benzene moiety - Phosphonic acid ester - Benzenoid - Organophosphonic acid derivative - Carboxamide group - Ketone - Secondary carboxylic acid amide - Carboxylic acid derivative - Thioether - Dialkylthioether - Hydrocarbon derivative - Organophosphorus compound - Organooxygen compound - Organonitrogen compound - Organic oxide - Organic nitrogen compound - Carbonyl group - 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