Compound Identification
SMILES
COC(=O)C1=C(N(N=N1)[C@@H]1CC[C@@H]2[C@H](Cl)CCC1S2=O)C(=O)OC
InChIKey
InChIKey=CEKVOBKJCKTYJZ-AAOCPJHKSA-N
Formula
C14H18ClN3O5S
Mass
375.82
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Thianes
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Thianes
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Thianes
Alternative Parents
Vinylogous amides Triazoles Methyl esters Heteroaromatic compounds Sulfoxides Sulfinyl compounds Azacyclic compounds Organooxygen compounds Organonitrogen compounds Organochlorides Organic oxides Hydrocarbon derivatives Alkyl chlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Thiane - Azole - 1,2,3-triazole - Methyl ester - Heteroaromatic compound - Vinylogous amide - Carboxylic acid ester - Sulfoxide - Sulfinyl compound - Carboxylic acid derivative - Azacycle - Organic oxide - Organic oxygen compound - Alkyl halide - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Alkyl chloride - Organic nitrogen compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as thianes. These are heterocyclic compounds containing a saturated six-member ring with five carbon atoms and one sulfur atom.
External Descriptors
Not available