Compound Identification
SMILES
COC1=C(C)C=C2C(CCCC2=NOC(=O)C2=C(Cl)C=CC(SC)=C2)=C1
InChIKey
InChIKey=LKJAZZBUMIZHSK-UHFFFAOYSA-N
Formula
C20H20ClNO3S
Mass
389.89
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
- Class Tetralins
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Tetralins
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Tetralins
Alternative Parents
2-halobenzoic acids and derivatives M-sulfanylbenzoic acids and derivatives Thiophenol ethers Anisoles Benzoyl derivatives Alkyl aryl ethers Alkylarylthioethers Chlorobenzenes Aryl chlorides Vinylogous halides Oxime esters Sulfenyl compounds Carboxylic acids and derivatives Organic oxides Organochlorides Hydrocarbon derivatives
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
M-sulfanylbenzoic acid or derivatives - Tetralin - 2-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzoic acid or derivatives - Benzoyl - Phenol ether - Aryl thioether - Anisole - Thiophenol ether - Halobenzene - Alkyl aryl ether - Chlorobenzene - Alkylarylthioether - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Oximester - Vinylogous halide - Sulfenyl compound - Thioether - Carboxylic acid derivative - Ether - Organooxygen compound - Organosulfur compound - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organochloride - Organohalogen compound - Aromatic homopolycyclic compound
Description
This compound belongs to the class of organic compounds known as tetralins. These are polycyclic aromatic compounds containing a tetralin moiety, which consists of a benzene fused to a cyclohexane.
External Descriptors
Not available