Compound Identification
SMILES
[O-][N+](=O)C1=C(SC2=CC=C(Br)C=C2)C=CC(=C1)C(=O)NCCCN1CCCC1=O
InChIKey
InChIKey=JGHLKBKAYQUYAK-UHFFFAOYSA-N
Formula
C20H20BrN3O4S
Mass
478.36
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
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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
P-sulfanylbenzoic acids and derivatives Benzamides Nitrobenzenes Thiophenol ethers Benzoyl derivatives Nitroaromatic compounds Bromobenzenes Aryl bromides Pyrrolidine-2-ones N-alkylpyrrolidines Tertiary carboxylic acid amides Secondary carboxylic acid amides Lactams Sulfenyl compounds Azacyclic compounds Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Hydrocarbon derivatives Carbonyl compounds Organonitrogen compounds Organobromides Organic zwitterions Organopnictogen compounds Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Diarylthioether - P-sulfanylbenzoic acid or derivatives - Benzamide - Benzoic acid or derivatives - Nitrobenzene - Nitroaromatic compound - Benzoyl - Thiophenol ether - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Pyrrolidone - 2-pyrrolidone - N-alkylpyrrolidine - Benzenoid - Tertiary carboxylic acid amide - Pyrrolidine - Carboxamide group - Secondary carboxylic acid amide - Lactam - C-nitro compound - Organic nitro compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Sulfenyl compound - Organoheterocyclic compound - Carboxylic acid derivative - Azacycle - Organic oxoazanium - Hydrocarbon derivative - Organic oxygen compound - Organic zwitterion - Carbonyl group - Organic nitrogen compound - Organopnictogen compound - Organooxygen compound - Organohalogen compound - Organic oxide - Organobromide - Organonitrogen compound - 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