Compound Identification
SMILES
CC(C)C1=NC(SC2=CC=C(CCC(O)=O)C=C2)=C(N1CC1=CC2=C(OCO2)C=C1Cl)C(O)=O
InChIKey
InChIKey=KQLGFTNAWIYIBA-UHFFFAOYSA-N
Formula
C24H23ClN2O6S
Mass
502.97
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organosulfur compounds
-
Class
Thioethers
-
Subclass
Aryl thioethers
- Level 5 Diarylthioethers
-
Subclass
Aryl thioethers
-
Class
Thioethers
-
Superclass
Organosulfur compounds
Kingdom
Organic compounds
Superclass
Organosulfur compounds
Class
Thioethers
Subclass
Aryl thioethers
Intermediate Tree Nodes
Not available
Direct Parent
Diarylthioethers
Alternative Parents
Phenylpropanoic acids 1,2,4,5-tetrasubstituted imidazoles Benzodioxoles Thiophenol ethers Carbonylimidazoles Vinylogous thioesters Aryl chlorides N-substituted imidazoles Benzene and substituted derivatives Dicarboxylic acids and derivatives Heteroaromatic compounds Sulfenyl compounds Oxacyclic compounds Acetals Azacyclic compounds Carboxylic acids Carbonyl compounds Hydrocarbon derivatives Organic oxides Organochlorides Organonitrogen compounds Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
3-phenylpropanoic-acid - Diarylthioether - 1,2,4,5-tetrasubstituted imidazole - Benzodioxole - Thiophenol ether - Imidazole-4-carbonyl group - Dicarboxylic acid or derivatives - N-substituted imidazole - Aryl chloride - Monocyclic benzene moiety - Aryl halide - Benzenoid - Vinylogous thioester - Azole - Heteroaromatic compound - Imidazole - Carboxylic acid derivative - Carboxylic acid - Sulfenyl compound - Acetal - Organoheterocyclic compound - Azacycle - Oxacycle - Organic nitrogen compound - Organohalogen compound - Organochloride - Carbonyl group - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as diarylthioethers. These are organosulfur compounds containing a thioether group that is substituted by two aryl groups.
External Descriptors
Not available