Compound Identification
SMILES
Nc1ncc(C(=O)NCCc2ccccc2)c2nc(nn12)-c1ccco1
InChIKey
InChIKey=QSEZHCRHSSPFSF-UHFFFAOYSA-N
Formula
C18H16N6O2
Mass
348.366
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
Pyrimidinecarboxamides Aminopyrimidines and derivatives Benzene and substituted derivatives Vinylogous amides Triazoles Furans Heteroaromatic compounds Amino acids and derivatives Secondary carboxylic acid amides Azacyclic compounds Oxacyclic compounds Organooxygen compounds Organic oxides Hydrocarbon derivatives Organopnictogen compounds Primary amines
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pyrimidinecarboxamide - Triazolopyrimidine - Pyrimidine-5-carboxylic acid or derivatives - Aminopyrimidine - Monocyclic benzene moiety - Benzenoid - Pyrimidine - Azole - Heteroaromatic compound - Furan - Vinylogous amide - 1,2,4-triazole - Triazole - Amino acid or derivatives - Carboxamide group - Secondary carboxylic acid amide - Carboxylic acid derivative - Oxacycle - Azacycle - Organonitrogen compound - Organic nitrogen compound - Amine - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organooxygen compound - Primary amine - 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