Compound Identification
SMILES
CC1=C(SC2=CC(=C(Cl)C=C2)[N+]([O-])=O)C=C(C(O)=C1C(O)=O)C(C)(C)C
InChIKey
InChIKey=LVVLCFYGDZNJNY-UHFFFAOYSA-N
Formula
C18H18ClNO5S
Mass
395.85
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organosulfur compounds
-
Class
Thioethers
-
Subclass
Aryl thioethers
- Level 5 Diarylthioethers
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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
Salicylic acids M-sulfanylbenzoic acids Benzoic acids Phenylpropanes Nitrobenzenes Thiophenol ethers Benzoyl derivatives Meta cresols Nitroaromatic compounds Toluenes Chlorobenzenes Aryl chlorides Vinylogous acids Sulfenyl compounds Propargyl-type 1,3-dipolar organic compounds Carboxylic acids Organic oxoazanium compounds Organochlorides Hydrocarbon derivatives Organonitrogen compounds Organic salts Organooxygen compounds Organic oxides Organic cations
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Diarylthioether - Salicylic acid - M-sulfanylbenzoic acid - Hydroxybenzoic acid - Salicylic acid or derivatives - M-sulfanylbenzoic acid or derivatives - Phenylpropane - Benzoic acid - Nitrobenzene - Benzoic acid or derivatives - Benzoyl - Thiophenol ether - M-cresol - Nitroaromatic compound - Chlorobenzene - Halobenzene - Toluene - Phenol - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Vinylogous acid - Organic nitro compound - C-nitro compound - Organic 1,3-dipolar compound - Carboxylic acid derivative - Carboxylic acid - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Sulfenyl compound - Organic oxoazanium - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organic salt - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Organic cation - Aromatic homomonocyclic 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