Compound Identification
SMILES
CC1CCC2=C(C1)C1=C(S2)N2C(SCC(=O)NCC3=CC=CO3)=NN=C2N2N=CN=C12
InChIKey
InChIKey=BSALUVKYDSHOTG-UHFFFAOYSA-N
Formula
C20H19N7O2S2
Mass
453.54
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Triazolopyrimidines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Triazolopyrimidines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Triazolopyrimidines
Alternative Parents
Thienopyrimidines Alkylarylthioethers Pyrimidines and pyrimidine derivatives Triazoles Thiophenes Furans Heteroaromatic compounds Secondary carboxylic acid amides Sulfenyl compounds Azacyclic compounds Oxacyclic compounds Organopnictogen compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Thienopyrimidine - Triazolopyrimidine - Aryl thioether - Alkylarylthioether - Pyrimidine - Azole - Furan - Thiophene - Triazole - 1,2,4-triazole - Heteroaromatic compound - Carboxamide group - Secondary carboxylic acid amide - Oxacycle - Carboxylic acid derivative - Azacycle - Thioether - Sulfenyl compound - Hydrocarbon derivative - Organic nitrogen compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic oxide - Carbonyl group - Organopnictogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as triazolopyrimidines. These are polycyclic aromatic compounds containing triazole ring fused to a pyrimidine ring. Triazole is a five-membered ring consisting of two carbon atoms and three nitrogen atoms. Pyrimidine is a 6-membered ring consisting of four carbon atoms and two nitrogen centers at the 1- and 3- ring positions.
External Descriptors
Not available