Compound Identification
SMILES
Oc1nc(nc2n(Cc3ccccc3Cl)nnc12)C(=O)NCc1ccco1
InChIKey
InChIKey=IJQIIPRLFSVJQO-UHFFFAOYSA-N
Formula
C17H13ClN6O3
Mass
384.78
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 2-heteroaryl carboxamides Chlorobenzenes Hydroxypyrimidines Aryl chlorides Triazoles Furans Heteroaromatic compounds Secondary carboxylic acid amides Oxacyclic compounds Azacyclic compounds Organochlorides Organonitrogen compounds Organooxygen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pyrimidinecarboxamide - Pyrimidine-2-carboxylic acid or derivatives - Triazolopyrimidine - 2-heteroaryl carboxamide - Chlorobenzene - Halobenzene - Hydroxypyrimidine - Aryl halide - Benzenoid - Pyrimidine - Monocyclic benzene moiety - Aryl chloride - Heteroaromatic compound - Azole - 1,2,3-triazole - Triazole - Furan - Secondary carboxylic acid amide - Carboxamide group - Oxacycle - Azacycle - Carboxylic acid derivative - Organooxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Organonitrogen compound - Organohalogen compound - Organochloride - 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