Compound Identification
SMILES
OC(=O)CC1SC2=N[C@@H]3[C@H](CCC4=CC=CC=C34)N2C1(O)C1=CC=C(Cl)C=C1
InChIKey
InChIKey=VMFCQJDREDNHSP-BNYILAJESA-N
Formula
C21H19ClN2O3S
Mass
414.9
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
Chlorobenzenes Aryl chlorides Thiazolidines Imidazolines Azoles Isothioureas Propargyl-type 1,3-dipolar organic compounds Alkanolamines Monocarboxylic acids and derivatives Azacyclic compounds Carboxylic acids Carboximidamides Carbonyl compounds Hydrocarbon derivatives Organic oxides Organochlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Tetralin - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Azole - 2-imidazoline - Thiazolidine - Isothiourea - Alkanolamine - Carboxylic acid derivative - Carboxylic acid - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Monocarboxylic acid or derivatives - Carboximidamide - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Carbonyl group - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Aromatic heteropolycyclic 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