Compound Identification
SMILES
NC1=NC(=S)C2=C(N1)N(COCC1COP(O)O1)C=N2
InChIKey
InChIKey=QFHHDIJMBDKODQ-UHFFFAOYSA-N
Formula
C9H12N5O4PS
Mass
317.26
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 Purinethiones
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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
Purinethiones
Alternative Parents
Pyrimidinethiones Aminopyrimidines and derivatives N-substituted imidazoles Organic phosphites Heteroaromatic compounds Dioxaphospholanes Oxacyclic compounds Azacyclic compounds Primary amines Organosulfur compounds Organooxygen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Purinethione - Aminopyrimidine - Pyrimidinethione - N-substituted imidazole - Pyrimidine - Azole - 1,3_dioxaphospholane - Heteroaromatic compound - Imidazole - Organic phosphite - Oxacycle - Azacycle - Organonitrogen compound - Primary amine - Organic nitrogen compound - Amine - Hydrocarbon derivative - Organic oxygen compound - Organooxygen compound - Organosulfur compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as purinethiones. These are purines in which the purine moiety bears a thioketone.
External Descriptors
Not available