Compound Identification
SMILES
COCCN1C=NC2=C1C(=O)N(CC(=O)NC1=C(F)C=C(F)C=C1)C(=O)N2CC1=CC=CC=C1
InChIKey
InChIKey=GFPSPTNBHUSCGR-UHFFFAOYSA-N
Formula
C23H21F2N5O4
Mass
469.449
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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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 Anilides N-arylamides Pyrimidones Fluorobenzenes N-substituted imidazoles Aryl fluorides Vinylogous amides Heteroaromatic compounds Ureas Secondary carboxylic acid amides Lactams Dialkyl ethers Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organofluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Xanthine - 6-oxopurine - Purinone - Anilide - Alkaloid or derivatives - N-arylamide - Halobenzene - Fluorobenzene - Pyrimidone - Monocyclic benzene moiety - N-substituted imidazole - Aryl fluoride - Pyrimidine - Aryl halide - Benzenoid - Azole - Imidazole - Heteroaromatic compound - Vinylogous amide - Lactam - Secondary carboxylic acid amide - Urea - Carboxamide group - Azacycle - Carboxylic acid derivative - Dialkyl ether - Ether - Organic oxygen compound - Organooxygen compound - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organofluoride - Organohalogen compound - 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