Compound Identification
SMILES
COC1=C(OCC(=O)NC2=C(F)C=C(Br)C=C2)C=CC(=C1)C1CC(=O)N=C2N=CNN12
InChIKey
InChIKey=LCHIYMRWDYFUMD-UHFFFAOYSA-N
Formula
C20H17BrFN5O4
Mass
490.289
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
Anilides Phenoxy compounds Anisoles N-arylamides Methoxybenzenes Pyrimidones Alkyl aryl ethers Fluorobenzenes Bromobenzenes Hydropyrimidines Aryl bromides Aryl fluorides Triazolines Secondary carboxylic acid amides Amidrazones N-acylimines Propargyl-type 1,3-dipolar organic compounds Formamidines Azacyclic compounds Hydrocarbon derivatives Organic oxides Organofluorides Organobromides Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Triazolopyrimidine - Anilide - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - N-arylamide - Alkyl aryl ether - Halobenzene - Fluorobenzene - Pyrimidone - Bromobenzene - 1,4,5,6-tetrahydropyrimidine - Hydropyrimidine - Aryl bromide - Pyrimidine - Aryl fluoride - Benzenoid - Monocyclic benzene moiety - Aryl halide - Triazoline - Secondary carboxylic acid amide - Carboxylic acid amidrazone - N-acylimine - Carboxamide group - Amidine - Formamidine - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Ether - Organooxygen compound - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Organofluoride - Organobromide - Organohalogen compound - Imine - 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