Compound Identification
SMILES
Br.Br.CN1C2=C(N(CCN3CCN(CCO)CC3)C=N2)C(=O)N(C)C1=O
InChIKey
InChIKey=VEUDWKJPUNUZKN-UHFFFAOYSA-N
Formula
C15H26Br2N6O3
Mass
498.22
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
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Class
Imidazopyrimidines
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Subclass
Purines and purine derivatives
- Level 5 Xanthines
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Subclass
Purines and purine derivatives
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Class
Imidazopyrimidines
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Imidazopyrimidines
Subclass
Purines and purine derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Xanthines
Alternative Parents
6-oxopurines Alkaloids and derivatives N-alkylpiperazines Pyrimidones N-substituted imidazoles Heteroaromatic compounds Vinylogous amides 1,2-aminoalcohols Lactams Ureas Trialkylamines Azacyclic compounds Primary alcohols Organic oxides Hydrocarbon derivatives Hydrobromides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Xanthine - 6-oxopurine - Purinone - Alkaloid or derivatives - Pyrimidone - N-alkylpiperazine - 1,4-diazinane - N-substituted imidazole - Piperazine - Pyrimidine - Azole - Imidazole - Heteroaromatic compound - Vinylogous amide - Urea - Tertiary aliphatic amine - Tertiary amine - 1,2-aminoalcohol - Lactam - Alkanolamine - Azacycle - Hydrobromide - Organic oxide - Organonitrogen compound - Organic nitrogen compound - Organic oxygen compound - Organooxygen compound - Amine - Hydrocarbon derivative - Primary alcohol - Alcohol - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as xanthines. These are purine derivatives with a ketone group conjugated at carbons 2 and 6 of the purine moiety.
External Descriptors
Not available