Compound Identification
SMILES
CCNc1nc(SNC(=O)NS(=O)(=O)c2ccsc2C(=O)OC)nc(n1)N(CC)CC
InChIKey
InChIKey=OCIZSEQAQYXHPD-UHFFFAOYSA-N
Formula
C16H23N7O5S3
Mass
489.58
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organic nitrogen compounds
-
Class
Organonitrogen compounds
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Subclass
Sulfonylureas
- Level 5 N-sulfenyl-N'-sulfonyl-ureas
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Subclass
Sulfonylureas
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Class
Organonitrogen compounds
-
Superclass
Organic nitrogen compounds
Kingdom
Organic compounds
Superclass
Organic nitrogen compounds
Class
Organonitrogen compounds
Subclass
Sulfonylureas
Intermediate Tree Nodes
Not available
Direct Parent
N-sulfenyl-N'-sulfonyl-ureas
Alternative Parents
Thiophene carboxylic acids and derivatives 1,3,5-triazine-2,4-diamines Dialkylarylamines N-aliphatic s-triazines 1,3,5-triazines Organosulfonic acids and derivatives Methyl esters Aminosulfonyl compounds Heteroaromatic compounds Sulfenyl compounds Monocarboxylic acids and derivatives Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organopnictogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N-sulfenyl-np-sulfonyl-urea - 2,4-diamine-s-triazine - Thiophene carboxylic acid or derivatives - Dialkylarylamine - Amino-1,3,5-triazine - Aminotriazine - N-aliphatic s-triazine - Triazine - 1,3,5-triazine - Heteroaromatic compound - Methyl ester - Organic sulfonic acid or derivatives - Aminosulfonyl compound - Organosulfonic acid or derivatives - Sulfonyl - Thiophene - Carboxylic acid ester - Azacycle - Carboxylic acid derivative - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Sulfenyl compound - Organooxygen compound - Organopnictogen compound - Organic oxygen compound - Organosulfur compound - Carbonyl group - Hydrocarbon derivative - Amine - Organic oxide - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as n-sulfenyl-n'-sulfonyl-ureas. These are urea derivatives that carry a sulfonyl group at one nitrogen atom of the urea backbone, and a sulfenyl group at the other nitrogen atom.
External Descriptors
Not available