Compound Identification
SMILES
COC(=O)C1=C(C=C(C=C1)[N+]([O-])=O)S(=O)(=O)NC(=O)NC1=NC(OC)=NC(C)=N1
InChIKey
InChIKey=WCQBRKZQMKJFGG-UHFFFAOYSA-N
Formula
C14H14N6O8S
Mass
426.36
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organic nitrogen compounds
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Class
Organonitrogen compounds
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Subclass
Sulfonylureas
- Level 5 S-triazinyl-2-sulfonylureas
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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
S-triazinyl-2-sulfonylureas
Alternative Parents
Nitrobenzoic acids and derivatives Benzenesulfonamides Benzoic acid esters Benzenesulfonyl compounds Nitrobenzenes 2-methoxy-1,3,5-triazines Nitroaromatic compounds Benzoyl derivatives Alkyl aryl ethers Aminotriazines Organosulfonic acids and derivatives Aminosulfonyl compounds Methyl esters Heteroaromatic compounds Azacyclic compounds Organic oxoazanium compounds Propargyl-type 1,3-dipolar organic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organic salts Organic zwitterions
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
S-triazinyl-2-sulfonylurea - Nitrobenzoate - Benzenesulfonamide - Benzoate ester - Benzenesulfonyl group - Benzoic acid or derivatives - Nitrobenzene - 2-methoxy-1,3,5-triazine - Alkoxy-s-triazine - Nitroaromatic compound - Benzoyl - Alkyl aryl ether - Amino-1,3,5-triazine - Monocyclic benzene moiety - 1,3,5-triazine - Triazine - Benzenoid - Heteroaromatic compound - Methyl ester - Aminosulfonyl compound - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Organic nitro compound - Carboxylic acid ester - C-nitro compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Azacycle - Carboxylic acid derivative - Ether - Organoheterocyclic compound - Organic oxoazanium - Carbonyl group - Hydrocarbon derivative - Organic oxygen compound - Organosulfur compound - Organic oxide - Organic salt - Organic zwitterion - Organooxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as s-triazinyl-2-sulfonylureas. These are aromatic heterocyclic compounds containing a s-triazine ring which is substituted with a urea at the ring 2-position.
External Descriptors
Not available