Compound Identification
SMILES
CCO[C@@H]1C[C@@H](C2=CN=CC=C2)C(=C(SCC)S1)P(=O)(OCC)OCC
InChIKey
InChIKey=WOJRFDTXSNUGIB-HOTGVXAUSA-N
Formula
C18H28NO4PS2
Mass
417.52
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
Class
Organic phosphonic acids and derivatives
- Subclass Phosphonic acid diesters
-
Class
Organic phosphonic acids and derivatives
-
Superclass
Organic acids and derivatives
Kingdom
Organic compounds
Superclass
Organic acids and derivatives
Class
Organic phosphonic acids and derivatives
Subclass
Phosphonic acid diesters
Intermediate Tree Nodes
Not available
Direct Parent
Phosphonic acid diesters
Alternative Parents
Thiopyrans Pyridines and derivatives Phosphonic acid esters Monothioacetals Heteroaromatic compounds Sulfenyl compounds Azacyclic compounds Organophosphorus compounds Organooxygen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phosphonic acid diester - Phosphonic acid ester - Pyridine - Thiopyran - Monothioacetal - Heteroaromatic compound - Sulfenyl compound - Azacycle - Organoheterocyclic compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organosulfur compound - Organophosphorus compound - Organooxygen compound - Organic nitrogen compound - Organonitrogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as phosphonic acid diesters. These are organophosphorus compounds containing a diester derivative of phosphonic acid, with the general structure ROP(=O)OR' (R,R' = organyl group).
External Descriptors
Not available