Compound Identification
SMILES
COC(=O)C1=C(NN2C1=NC=NC2=O)SCC1=CC=CC=C1
InChIKey
InChIKey=KVWZDGVMMABZHL-UHFFFAOYSA-N
Formula
C14H12N4O3S
Mass
316.34
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Pyrazolotriazines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyrazolotriazines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Pyrazolotriazines
Alternative Parents
Pyrazolo[1,5-a][1,3,5]triazines Pyrazole carboxylic acids and derivatives Triazinones Alkylarylthioethers Vinylogous thioesters 1,3,5-triazines Benzene and substituted derivatives Vinylogous amides Heteroaromatic compounds Methyl esters Sulfenyl compounds Azacyclic compounds Organonitrogen compounds Organooxygen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pyrazolotriazine - Pyrazolo[1,5-a][1,3,5]triazine - Aryl thioether - Pyrazole-4-carboxylic acid or derivatives - Triazinone - Alkylarylthioether - Triazine - Monocyclic benzene moiety - Benzenoid - Vinylogous thioester - 1,3,5-triazine - Vinylogous amide - Methyl ester - Azole - Pyrazole - Heteroaromatic compound - Carboxylic acid ester - Carboxylic acid derivative - Azacycle - Sulfenyl compound - Thioether - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as pyrazolotriazines. These are compounds containing a pyrazolotriazine skeleton, which consists of a pyrazole fused to a triazine. Pyrazole is 5-membered ring consisting of three carbon atoms and two adjacent nitrogen centers. Triazine is a 6-membered ring consisting of three carbon atoms and three nitrogen centers.
External Descriptors
Not available