Compound Identification
SMILES
CCCCCN1C2N(OC(=O)C(F)(F)F)N=C(N2C(=O)C2=C1N=C(Br)N2)C1=NC=CN=C1
InChIKey
InChIKey=PFXOGODSSJEYBQ-UHFFFAOYSA-N
Formula
C17H16BrF3N8O3
Mass
517.267
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Imidazopyrimidines
- Subclass Purines and purine derivatives
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Class
Imidazopyrimidines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Imidazopyrimidines
Subclass
Purines and purine derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Purines and purine derivatives
Alternative Parents
Dialkylarylamines Pyrazines Aryl bromides Imidolactams Vinylogous amides Triazolines Alpha-halocarboxylic acid derivatives Heteroaromatic compounds Imidazoles Orthocarboxylic acid derivatives Amidrazones Ortho amides Azacyclic compounds Monocarboxylic acids and derivatives Organobromides Organofluorides Carbonyl compounds Alkyl fluorides Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Purine - Dialkylarylamine - Aryl bromide - Aryl halide - Pyrazine - Imidolactam - Alpha-halocarboxylic acid derivative - Alpha-halocarboxylic acid or derivatives - Azole - Imidazole - Triazoline - Vinylogous amide - Heteroaromatic compound - Ortho amide - Carboxylic acid amidrazone - Orthocarboxylic acid derivative - Azacycle - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Organooxygen compound - Organohalogen compound - Alkyl halide - Organobromide - Carbonyl group - Alkyl fluoride - Organic oxygen compound - Organic nitrogen compound - Organofluoride - Organonitrogen compound - Organic oxide - Hydrocarbon derivative - Amine - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as purines and purine derivatives. These are aromatic heterocyclic compounds containing a purine moiety, which is formed a pyrimidine-ring ring fused to an imidazole ring.
External Descriptors
Not available