Compound Identification
SMILES
N=C(C(C#N)C(=S)SCCC#N)C1=CC=CC=C1
InChIKey
InChIKey=YBZVFLZGMRXQRW-UHFFFAOYSA-N
Formula
C13H11N3S2
Mass
273.37
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Benzene and substituted derivatives
Alternative Parents
Ketimines Dithiocarboxylic acid esters Carbodithioic acid esters Sulfenyl compounds Nitriles Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Monocyclic benzene moiety - Ketimine - Dithiocarboxylic acid ester - Carbodithioic ester - Carbonitrile - Dithiocarboxylic acid or derivatives - Sulfenyl compound - Nitrile - Organic nitrogen compound - Organonitrogen compound - Organosulfur compound - Hydrocarbon derivative - Cyanide - Imine - Carbonyl group - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as benzene and substituted derivatives. These are aromatic compounds containing one monocyclic ring system consisting of benzene.
External Descriptors
Not available