Compound Identification
SMILES
OCCCC1=NC2=NC(=CC(N2N1)C1=CC=CO1)C1=CC=C(Cl)C=C1
InChIKey
InChIKey=DFFPPAWGPVCGLF-UHFFFAOYSA-N
Formula
C18H17ClN4O2
Mass
356.81
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
Chlorobenzenes Aryl chlorides Hydropyrimidines Imidolactams Heteroaromatic compounds Furans Triazolines Amidrazones Amidines Azacyclic compounds Oxacyclic compounds Propargyl-type 1,3-dipolar organic compounds Organopnictogen compounds Organochlorides Hydrocarbon derivatives Primary alcohols
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Triazolopyrimidine - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Imidolactam - Hydropyrimidine - Benzenoid - 1,6-dihydropyrimidine - Triazoline - Heteroaromatic compound - Furan - Carboxylic acid amidrazone - Amidine - Oxacycle - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Organic oxygen compound - Organic nitrogen compound - Alcohol - Hydrocarbon derivative - Organopnictogen compound - Primary alcohol - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen 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