Compound Identification
SMILES
ClC1=CSC(=C1S(=O)(=O)N=C=S)C1=NOCCO1
InChIKey
InChIKey=HETDEXXQYNXZIW-UHFFFAOYSA-N
Formula
C8H5ClN2O4S3
Mass
324.77
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organosulfur compounds
-
Class
Sulfonyls
- Subclass Sulfonyl isothiocyanates
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Class
Sulfonyls
-
Superclass
Organosulfur compounds
Kingdom
Organic compounds
Superclass
Organosulfur compounds
Class
Sulfonyls
Subclass
Sulfonyl isothiocyanates
Intermediate Tree Nodes
Not available
Direct Parent
Sulfonyl isothiocyanates
Alternative Parents
Aryl chlorides Thiophenes Organosulfonic acids and derivatives Heteroaromatic compounds Oxacyclic compounds Azacyclic compounds Organooxygen compounds Organonitrogen compounds Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Sulfonyl isothiocyanate - Aryl chloride - Aryl halide - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Thiophene - Heteroaromatic compound - Azacycle - Organoheterocyclic compound - Oxacycle - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Hydrocarbon derivative - Organic oxide - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as sulfonyl isothiocyanates. These are organosulfur compounds that contain a sulfonyl group connected to an isothiocyanate group.
External Descriptors
Not available