Compound Identification
SMILES
CC1=CC(C)=NC(NC(=O)NS(=O)(=O)C2=CC=CC=C2[N+]([O-])=O)=N1
InChIKey
InChIKey=NAOVPZPOSVJBCV-UHFFFAOYSA-N
Formula
C13H13N5O5S
Mass
351.34
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 Pyrimidinyl-2-sulfonylureas
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Subclass
Sulfonylureas
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Class
Organonitrogen compounds
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Superclass
Organic nitrogen compounds
Kingdom
Organic compounds
Superclass
Organic nitrogen compounds
Class
Organonitrogen compounds
Subclass
Sulfonylureas
Intermediate Tree Nodes
Not available
Direct Parent
Pyrimidinyl-2-sulfonylureas
Alternative Parents
Benzenesulfonamides Nitrobenzenes Benzenesulfonyl compounds Nitroaromatic compounds Pyrimidines and pyrimidine derivatives Organosulfonic acids and derivatives Aminosulfonyl compounds Heteroaromatic compounds Organic carbonic acids and derivatives Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxoazanium compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organic zwitterions Organopnictogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Pyrimidinyl-2-sulfonylurea - Benzenesulfonamide - Benzenesulfonyl group - Nitrobenzene - Nitroaromatic compound - Monocyclic benzene moiety - Pyrimidine - Benzenoid - Heteroaromatic compound - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Sulfonyl - Aminosulfonyl compound - C-nitro compound - Carbonic acid derivative - Organic nitro compound - Azacycle - Organic oxoazanium - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organooxygen compound - Organic oxygen compound - Organosulfur compound - Organopnictogen compound - Carbonyl group - Organic oxide - Hydrocarbon derivative - Organic zwitterion - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as pyrimidinyl-2-sulfonylureas. These are aromatic heterocyclic compounds containing a pyrimidine ring which is substituted with a sulfonylurea at the ring 2-position.
External Descriptors
Not available