Compound Identification
SMILES
ClC1=CC(Cl)=C(C(=O)C#CC2=CC=CS2)C(Cl)=C1
InChIKey
InChIKey=KRCJGDCDUPLELR-UHFFFAOYSA-N
Formula
C13H5Cl3OS
Mass
315.59
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Benzoyl derivatives
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzoyl derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Benzoyl derivatives
Alternative Parents
Aryl ketones Chlorobenzenes Aryl chlorides Vinylogous halides Thiophenes Heteroaromatic compounds Alpha,beta-unsaturated ketones Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Benzoyl - Aryl ketone - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Heteroaromatic compound - Thiophene - Vinylogous halide - Alpha,beta-unsaturated ketone - Ketone - Organoheterocyclic compound - Organochloride - Organohalogen compound - Organooxygen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as benzoyl derivatives. These are organic compounds containing an acyl moiety of benzoic acid with the formula (C6H5CO-).
External Descriptors
Not available