Compound Identification
SMILES
COC(=O)[C@]1(C#N)[C@H](CSC11C2CC3CC(C2)CC1C3)C1=CC=CC=C1
InChIKey
InChIKey=SXQDWQQSEWHIAQ-LOVLPNRSSA-N
Formula
C22H25NO2S
Mass
367.51
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
Thiolanes Methyl esters Nitriles Monocarboxylic acids and derivatives Dialkylthioethers Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Monocyclic benzene moiety - Thiolane - Methyl ester - Carboxylic acid ester - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Carbonitrile - Nitrile - Thioether - Dialkylthioether - Organoheterocyclic compound - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Cyanide - Organic oxide - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Aromatic heteropolycyclic 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