Compound Identification
SMILES
CCCCOC1=C(C=C(Br)C=C1)C1N2NC=NC2=NC(C)=C1C(=O)OCCC
InChIKey
InChIKey=DRRQIZVJDVIVJR-UHFFFAOYSA-N
Formula
C20H25BrN4O3
Mass
449.349
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
Phenoxy compounds Phenol ethers Alkyl aryl ethers Bromobenzenes Aryl bromides Hydropyrimidines Enoate esters Triazolines Amidrazones Monocarboxylic acids and derivatives Formamidines Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Imines Hydrocarbon derivatives Carbonyl compounds Organic oxides Organobromides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Triazolopyrimidine - Phenoxy compound - Phenol ether - Alkyl aryl ether - Bromobenzene - Halobenzene - 1,6-dihydropyrimidine - Aryl bromide - Hydropyrimidine - Aryl halide - Monocyclic benzene moiety - Benzenoid - Triazoline - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Carboxylic acid amidrazone - Carboxylic acid ester - Amidine - Formamidine - Azacycle - Carboxylic acid derivative - Organic 1,3-dipolar compound - Ether - Propargyl-type 1,3-dipolar organic compound - Monocarboxylic acid or derivatives - Organic oxygen compound - Carbonyl group - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Imine - Organic nitrogen compound - Organohalogen compound - Organobromide - 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