Compound Identification
SMILES
CC1=CC=C(CSC#N)C=C1
InChIKey
InChIKey=DFKZGPBKYUQGAY-UHFFFAOYSA-N
Formula
C9H9NS
Mass
163.24
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Benzyl thiocyanates
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzyl thiocyanates
Intermediate Tree Nodes
Not available
Direct Parent
Benzyl thiocyanates
Alternative Parents
Toluenes Thiocyanates Sulfenyl compounds Organopnictogen compounds Organonitrogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Benzyl thiocyanate - Toluene - Sulfenyl compound - Thiocyanate - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organosulfur compound - Organonitrogen compound - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as benzyl thiocyanates. These are aromatic compounds containing an thiocyanate group that is S-substituted to a benzyl group.
External Descriptors
Not available