Compound Identification
SMILES
CCOP(=O)(OCC)C(CC1=CC=C(C=C1)S(=O)(=O)C(F)(F)F)C1=C(Cl)C2=CC=CC=C2S1
InChIKey
InChIKey=ZUPJJRKTPRDXKA-UHFFFAOYSA-N
Formula
C21H21ClF3O5PS2
Mass
540.93
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Benzothiophenes
- Subclass 1-benzothiophenes
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Class
Benzothiophenes
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzothiophenes
Subclass
1-benzothiophenes
Intermediate Tree Nodes
Not available
Direct Parent
1-benzothiophenes
Alternative Parents
Benzenesulfonyl compounds Dialkyl alkylphosphonates Phosphonic acid esters Aryl chlorides Thiophenes Sulfones Heteroaromatic compounds Trihalomethanes Organophosphorus compounds Organooxygen compounds Organofluorides Organochlorides Organic oxides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-benzothiophene - Benzenesulfonyl group - Dialkyl alkylphosphonate - Phosphonic acid diester - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Phosphonic acid ester - Benzenoid - Organophosphonic acid derivative - Sulfone - Sulfonyl - Thiophene - Heteroaromatic compound - Trihalomethane - Halomethane - Organosulfur compound - Organophosphorus compound - Organooxygen compound - Organofluoride - Organochloride - Alkyl fluoride - Organohalogen compound - Alkyl halide - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 1-benzothiophenes. These are aromatic heterocyclic compound containing the Benzo[b]thiophene ring system.
External Descriptors
Not available