Compound Identification
SMILES
CCCN1C2=C(N(C)C=N2)C2=NN=C(N2C1=O)C1=CC=CS1
InChIKey
InChIKey=BJWZTWHXLPIJQI-UHFFFAOYSA-N
Formula
C14H14N6OS
Mass
314.37
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
-
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
Triazolopyrimidines Pyrimidones N-substituted imidazoles Triazoles Thiophenes Heteroaromatic compounds Ureas Azacyclic compounds Organooxygen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Purinone - Triazolopyrimidine - Pyrimidone - N-substituted imidazole - Pyrimidine - Azole - Imidazole - Thiophene - Triazole - 1,2,4-triazole - Heteroaromatic compound - Urea - Azacycle - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - 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