Compound Identification
SMILES
CCOC(=O)CC1(O)CSC(N1C1=CC=CC=C1)=C(C#N)C(=O)OCC
InChIKey
InChIKey=VEINQIDDLKPVLT-UHFFFAOYSA-N
Formula
C18H20N2O5S
Mass
376.43
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
Vinylogous thioesters Dicarboxylic acids and derivatives Vinylogous amides Thiazolidines Enoate esters Ketene acetals Nitriles Azacyclic compounds Alkanolamines Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Vinylogous thioester - Thiazolidine - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Vinylogous amide - Carboxylic acid ester - Ketene acetal or derivatives - Azacycle - Carboxylic acid derivative - Organoheterocyclic compound - Carbonitrile - Nitrile - Alkanolamine - Cyanide - Carbonyl group - Organic oxygen compound - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organic oxide - Organic nitrogen compound - Aromatic heteromonocyclic 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