Compound Identification
SMILES
NC1=NC(=O)C2=C(N1)N(COCCO)C=N2.C\C(=N/NC(=S)NNC(=S)NC1=CC=CC=C1Cl)C1=CC=CC=N1
InChIKey
InChIKey=UGFOIOGHXCKPOW-ZIOFAICLSA-N
Formula
C23H26ClN11O3S2
Mass
604.11
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
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Level 5
Purinones
- Level 6 Hypoxanthines
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Level 5
Purinones
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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
Purinones
Direct Parent
Hypoxanthines
Alternative Parents
6-oxopurines Pyrimidones Aminopyrimidines and derivatives Chlorobenzenes Pyridines and derivatives Aryl chlorides N-substituted imidazoles Vinylogous amides Thiosemicarbazides Heteroaromatic compounds Azacyclic compounds Hydrocarbon derivatives Organic oxides Organochlorides Organosulfur compounds Primary alcohols Primary amines
Molecular Framework
Not available
Substituents
6-oxopurine - Hypoxanthine - Aminopyrimidine - Chlorobenzene - Halobenzene - Pyrimidone - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Pyrimidine - Pyridine - N-substituted imidazole - Azole - Heteroaromatic compound - Vinylogous amide - Thiosemicarbazide - Imidazole - Azacycle - Organohalogen compound - Primary amine - Organic oxygen compound - Amine - Alcohol - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organochloride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Primary alcohol - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as hypoxanthines. These are compounds containing the purine derivative 1H-purin-6(9H)-one. Purine is a bicyclic aromatic compound made up of a pyrimidine ring fused to an imidazole ring.
External Descriptors
Not available