Compound Identification
SMILES
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@@](O)(C(C(SC)SC)=C1C#N)C1=CC=CC=C1
InChIKey
InChIKey=DRPRBMJDLWYUIN-RFUYNDQBSA-N
Formula
C19H21NO5S2
Mass
407.5
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
Dicarboxylic acids and derivatives Tertiary alcohols Methyl esters Dithioacetals Sulfenyl compounds Nitriles Dialkylthioethers Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Thioacetal - Tertiary alcohol - Methyl ester - Carboxylic acid ester - Dialkylthioether - Carboxylic acid derivative - Carbonitrile - Nitrile - Thioether - Sulfenyl compound - Organonitrogen compound - Carbonyl group - Organic nitrogen compound - Cyanide - Organic oxygen compound - Organooxygen compound - Organosulfur compound - Organic oxide - Alcohol - Hydrocarbon derivative - 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