Compound Identification
SMILES
CCCC[C@H](CCSC1=CC(C)=C(OOC(=O)CCC)C=C1)C1=CC2=C(S1)C=C(C=C2)C(F)(F)F
InChIKey
InChIKey=OYSIRGHYYXXTHL-LJQANCHMSA-N
Formula
C27H31F3O3S2
Mass
524.66
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Benzothiophenes
- Subclass 1-benzothiophenes
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Class
Benzothiophenes
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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
Thiophenol ethers Phenoxy compounds 2,3,5-trisubstituted thiophenes Toluenes Alkylarylthioethers Peroxycarboxylic acids and derivatives Heteroaromatic compounds Sulfenyl compounds Monocarboxylic acids and derivatives Organofluorides Organic oxides Hydrocarbon derivatives Carbonyl compounds Alkyl fluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-benzothiophene - Phenoxy compound - Aryl thioether - Thiophenol ether - 2,3,5-trisubstituted thiophene - Toluene - Alkylarylthioether - Monocyclic benzene moiety - Benzenoid - Peroxycarboxylic acid or derivatives - Thiophene - Heteroaromatic compound - Thioether - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Sulfenyl compound - Organic oxide - Alkyl halide - Alkyl fluoride - Organosulfur compound - Organooxygen compound - Organofluoride - Organohalogen compound - Carbonyl group - Organic oxygen compound - Hydrocarbon derivative - 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