Compound Identification
SMILES
CC1=C(SCCO1)C(=O)NCCC1=C(Cl)C=C(C=N1)C(F)(F)F
InChIKey
InChIKey=SDDIJSWAEWVZAO-UHFFFAOYSA-N
Formula
C14H14ClF3N2O2S
Mass
366.78
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
Pyridines and derivatives Aryl chlorides Vinylogous esters Heteroaromatic compounds Thioenol ethers Secondary carboxylic acid amides Oxacyclic compounds Azacyclic compounds Organonitrogen compounds Organofluorides Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds Alkyl fluorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Aryl chloride - Aryl halide - 1,4-oxathiin - Pyridine - Heteroaromatic compound - Vinylogous ester - Carboxamide group - Secondary carboxylic acid amide - Thioenolether - Carboxylic acid derivative - Oxacycle - Azacycle - Organooxygen compound - Organonitrogen compound - Organofluoride - Organochloride - Organohalogen compound - Alkyl fluoride - Organic oxide - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Alkyl halide - Aromatic heteromonocyclic 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