Compound Identification
SMILES
COC(=O)CCSCC1=NN=NN1C1CCC(Cl)CC1
InChIKey
InChIKey=TVQJQWRYCFQLHV-UHFFFAOYSA-N
Formula
C12H19ClN4O2S
Mass
318.82
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organohalogen compounds
-
Class
Alkyl halides
- Subclass Cyclohexyl halides
-
Class
Alkyl halides
-
Superclass
Organohalogen compounds
Kingdom
Organic compounds
Superclass
Organohalogen compounds
Class
Alkyl halides
Subclass
Cyclohexyl halides
Intermediate Tree Nodes
Not available
Direct Parent
Cyclohexyl halides
Alternative Parents
Tetrazoles Methyl esters Heteroaromatic compounds Sulfenyl compounds Monocarboxylic acids and derivatives Dialkylthioethers Azacyclic compounds Organonitrogen compounds Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds Alkyl chlorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Cyclohexyl halide - Azole - Tetrazole - Methyl ester - Heteroaromatic compound - Carboxylic acid ester - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Thioether - Sulfenyl compound - Dialkylthioether - Organoheterocyclic compound - Azacycle - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organochloride - Organic oxide - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Alkyl chloride - Organic oxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as cyclohexyl halides. These are organohalogen compounds containing a monocyclic cyclohexane moiety that is substituted at one or more positions by an halogen atom.
External Descriptors
Not available