Compound Identification
SMILES
Cl.CCOC(=O)CCSC(N)=N
InChIKey
InChIKey=UAHVHCBLJXRXFW-UHFFFAOYSA-N
Formula
C6H13ClN2O2S
Mass
212.69
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organosulfur compounds
- Class Isothioureas
-
Superclass
Organosulfur compounds
Kingdom
Organic compounds
Superclass
Organosulfur compounds
Class
Isothioureas
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Isothioureas
Alternative Parents
Carboxylic acid esters Sulfenyl compounds Monocarboxylic acids and derivatives Carboximidamides Organic oxides Imines Hydrochlorides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aliphatic acyclic compounds
Substituents
Carboxylic acid ester - Isothiourea - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Carboximidamide - Sulfenyl compound - Carbonyl group - Hydrochloride - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Imine - Organic oxygen compound - Organic nitrogen compound - Aliphatic acyclic compound
Description
This compound belongs to the class of organic compounds known as isothioureas. These are organic compounds containing the isothiourea group, with the general structure R1SC(=NR2)N(R3)R4 (R1,R2,R3,R4=H, alkyl, aryl).
External Descriptors
Not available