Compound Identification
SMILES
CCCN1C2=C(NC(=N2)C2CCCC2)C2=NC(CC3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F)CN2C1=O
InChIKey
InChIKey=SMWTZSMIAGYANC-UHFFFAOYSA-N
Formula
C24H25F6N5O
Mass
513.488
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 Purinones
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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
Purinones
Alternative Parents
Trifluoromethylbenzenes Pyrimidones Imidolactams Heteroaromatic compounds Imidazoles Imidazolines Ureas Azacyclic compounds Carboxamidines Carboximidamides Propargyl-type 1,3-dipolar organic compounds Alkyl fluorides Carbonyl compounds Hydrocarbon derivatives Organopnictogen compounds Organofluorides Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Purinone - Trifluoromethylbenzene - Pyrimidone - Monocyclic benzene moiety - Pyrimidine - Benzenoid - Imidolactam - Heteroaromatic compound - Azole - Imidazole - 2-imidazoline - Urea - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Amidine - Carboximidamide - Carboxylic acid amidine - Organopnictogen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Organooxygen compound - Organic nitrogen compound - Alkyl halide - Carbonyl group - Alkyl fluoride - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as purinones. These are purines in which the purine moiety bears a C=O group. Purine is a bicyclic aromatic compound made up of a pyrimidine ring fused to an imidazole ring.
External Descriptors
Not available