Compound Identification
SMILES
[Cl-].COC1=C(C)C(CSSC2=CC=CC(F)=C2)=[N+](C=C1)C1=NC2=C(N1)C=C1C(=C2)C(C)(C)C(=O)C1(C)C
InChIKey
InChIKey=LBDYIMXVFUHFSB-UHFFFAOYSA-M
Formula
C28H29ClFN3O2S2
Mass
558.13
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Indanes
Subclass
Indanones
Intermediate Tree Nodes
Not available
Direct Parent
Indanones
Alternative Parents
Benzimidazoles Alkyl aryl ethers Fluorobenzenes Methylpyridines Pyridinium derivatives Aryl fluorides Heteroaromatic compounds Imidazoles Cyclic ketones Organic disulfides Sulfenyl compounds Azacyclic compounds Hydrocarbon derivatives Organonitrogen compounds Organic oxides Organofluorides Organic chloride salts Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Indanone - Benzimidazole - Alkyl aryl ether - Methylpyridine - Halobenzene - Fluorobenzene - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Pyridine - Pyridinium - Azole - Imidazole - Heteroaromatic compound - Organic disulfide - Ketone - Cyclic ketone - Organoheterocyclic compound - Azacycle - Ether - Sulfenyl compound - Organic nitrogen compound - Organic oxygen compound - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Carbonyl group - Organic salt - Organic chloride salt - Hydrocarbon derivative - Organic oxide - Organic cation - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as indanones. These are compounds containing an indane ring bearing a ketone group.
External Descriptors
Not available