Compound Identification
SMILES
COC(=O)CCC1=NC(C(C)C)=C(SC2=CC=CC(=C2)[N+]([O-])=O)N1CC1=CN=CC=C1
InChIKey
InChIKey=LYRNGHJXDAHDQB-UHFFFAOYSA-N
Formula
C22H24N4O4S
Mass
440.52
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
1,2,4,5-tetrasubstituted imidazoles Nitrobenzenes Thiophenol ethers Nitroaromatic compounds Imidazolyl carboxylic acids and derivatives Fatty acid esters Pyridines and derivatives N-substituted imidazoles Heteroaromatic compounds Methyl esters Sulfenyl compounds Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxoazanium compounds Monocarboxylic acids and derivatives Organonitrogen compounds Hydrocarbon derivatives Organic oxides Carbonyl compounds Organic salts Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Diarylthioether - 1,2,4,5-tetrasubstituted imidazole - Nitrobenzene - Nitroaromatic compound - Thiophenol ether - Imidazolyl carboxylic acid derivative - Fatty acid ester - Monocyclic benzene moiety - Pyridine - Benzenoid - Fatty acyl - N-substituted imidazole - Azole - Methyl ester - Heteroaromatic compound - Imidazole - Organic nitro compound - C-nitro compound - Carboxylic acid ester - Carboxylic acid derivative - Azacycle - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Sulfenyl compound - Organic salt - Organic oxide - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Organic cation - Aromatic heteromonocyclic 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