Compound Identification
SMILES
CSC1=NC(=O)C2=C(N1)N=C(N2CC1=CC=CC=C1)N1CCCC(N)C1
InChIKey
InChIKey=BFDLNXYPDJNQND-UHFFFAOYSA-N
Formula
C18H22N6OS
Mass
370.48
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 Dialkylarylamines Pyrimidones Alkylarylthioethers Aminopiperidines N-substituted imidazoles Aminoimidazoles Benzene and substituted derivatives Vinylogous amides Heteroaromatic compounds Sulfenyl compounds Azacyclic compounds Hydrocarbon derivatives Monoalkylamines Organic oxides Organooxygen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
6-oxopurine - Hypoxanthine - Aryl thioether - Dialkylarylamine - 3-aminopiperidine - Alkylarylthioether - Pyrimidone - Aminoimidazole - Monocyclic benzene moiety - N-substituted imidazole - Piperidine - Benzenoid - Pyrimidine - Azole - Heteroaromatic compound - Imidazole - Vinylogous amide - Azacycle - Sulfenyl compound - Thioether - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Primary aliphatic amine - Organic oxygen compound - Amine - Hydrocarbon derivative - Organic nitrogen compound - Organic oxide - Primary amine - 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