Compound Identification
SMILES
NC1=NC2=C(C=NN2CCCC2=CC3=C(OCO3)C=C2)C2=NC(=NN12)C1=CC=CO1
InChIKey
InChIKey=ULSNKDYWRFKLBP-UHFFFAOYSA-N
Formula
C20H17N7O3
Mass
403.402
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
Pyrazolo[3,4-d]pyrimidines Benzodioxoles Aminopyrimidines and derivatives Primary aromatic amines Benzenoids Triazoles Pyrazoles Heteroaromatic compounds Furans Oxacyclic compounds Azacyclic compounds Acetals Organopnictogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzodioxole - Pyrazolo[3,4-d]pyrimidine - Pyrazolopyrimidine - Triazolopyrimidine - Aminopyrimidine - Primary aromatic amine - Pyrimidine - Benzenoid - Azole - Furan - Pyrazole - Heteroaromatic compound - Triazole - 1,2,4-triazole - Acetal - Oxacycle - Azacycle - Organic nitrogen compound - Organopnictogen compound - Primary amine - Organooxygen compound - Organonitrogen compound - Amine - Hydrocarbon derivative - Organic oxygen 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