Compound Identification
SMILES
CC1=NC2=NC(=NN2C(C)=C1)S(=O)(=O)NC1=CC=C(C=C1)[N+]([O-])=O
InChIKey
InChIKey=HDKIRDXHOTWCGW-UHFFFAOYSA-N
Formula
C13H12N6O4S
Mass
348.34
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Triazolopyrimidines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Triazolopyrimidines
Subclass
1,2,4-triazolopyrimidine-2-sulfonamides
Intermediate Tree Nodes
Not available
Direct Parent
1,2,4-triazolopyrimidine-2-sulfonanilides
Alternative Parents
Sulfanilides Nitrobenzenes Nitroaromatic compounds Pyrimidines and pyrimidine derivatives Organosulfonamides Triazoles Aminosulfonyl compounds Heteroaromatic compounds Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxoazanium compounds Organic zwitterions Hydrocarbon derivatives Organic salts Organic oxides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1,2,4-triazolopyrimidine-2-sulfonanilide - Sulfanilide - Nitrobenzene - Nitroaromatic compound - Monocyclic benzene moiety - Pyrimidine - Organosulfonic acid amide - Benzenoid - Azole - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Heteroaromatic compound - Sulfonyl - Triazole - 1,2,4-triazole - Aminosulfonyl compound - C-nitro compound - Organic nitro compound - Organic oxoazanium - Azacycle - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organosulfur compound - Organic zwitterion - Organic salt - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 1,2,4-triazolopyrimidine-2-sulfonanilides. These are polycyclic aromatic compounds containing a 1,2,4-triazolo[1,5-a]pyrimidine ring system, which is substituted with a sulfonanilide at the 2-position.
External Descriptors
Not available