Compound Identification
SMILES
Br.OC1(C(CCC2=CC=CC=C2)SC2=NCCCN12)C1=CC(Cl)=CC=C1
InChIKey
InChIKey=VODJBWKSGYZDCC-UHFFFAOYSA-N
Formula
C20H22BrClN2OS
Mass
453.82
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Halobenzenes
- Level 5 Chlorobenzenes
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Subclass
Halobenzenes
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Halobenzenes
Intermediate Tree Nodes
Not available
Direct Parent
Chlorobenzenes
Alternative Parents
Hydropyrimidines Aryl chlorides Thiazolidines Isothioureas Propargyl-type 1,3-dipolar organic compounds Carboximidamides Azacyclic compounds Alkanolamines Organooxygen compounds Organochlorides Hydrocarbon derivatives Hydrobromides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Chlorobenzene - Aryl chloride - Aryl halide - Hydropyrimidine - 1,4,5,6-tetrahydropyrimidine - Thiazolidine - Isothiourea - Alkanolamine - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Carboximidamide - Propargyl-type 1,3-dipolar organic compound - Organohalogen compound - Organic nitrogen compound - Hydrobromide - Organochloride - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as chlorobenzenes. These are compounds containing one or more chlorine atoms attached to a benzene moiety.
External Descriptors
Not available