Compound Identification
SMILES
O=S1(=O)CC(N2CCOCC2)C2=C(O1)C1=C(CC2)N=C(S1)C1=CC=CC=C1
InChIKey
InChIKey=PUVHZQOWCLHURM-UHFFFAOYSA-N
Formula
C19H20N2O4S2
Mass
404.5
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Oxathiins
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Oxathiins
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Oxathiins
Alternative Parents
Sulfonic acid esters Organosulfonic acid esters Morpholines Benzene and substituted derivatives Thiazoles Heteroaromatic compounds Trialkylamines Oxacyclic compounds Dialkyl ethers Azacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Monocyclic benzene moiety - Morpholine - 1,2-oxathiin - Oxazinane - Sulfonic acid ester - Organosulfonic acid ester - Benzenoid - Azole - Organic sulfonic acid or derivatives - Heteroaromatic compound - Organosulfonic acid or derivatives - Thiazole - Tertiary amine - Tertiary aliphatic amine - Ether - Oxacycle - Dialkyl ether - Azacycle - Organic nitrogen compound - Amine - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as oxathiins. These are compounds containing an oxathiin moiety, which consists of an unsaturated aliphatic six-member ring with one oxygen atom, a sulfur atom, and four carbon atoms. Isomers of oxaphospholane include 1,2-oxathiin, 1,3-oxathiin,and 1,4-oxathiin.
External Descriptors
Not available