Compound Identification
SMILES
[Cl-].CN1C2=C([NH+](C)C(=S)N2)C(=O)N(C)C1=O
InChIKey
InChIKey=VJTLRONPTOKCQJ-UHFFFAOYSA-N
Formula
C8H11ClN4O2S
Mass
262.71
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
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Class
Imidazopyrimidines
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Subclass
Purines and purine derivatives
- Level 5 Xanthines
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Subclass
Purines and purine derivatives
-
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
Xanthines
Alternative Parents
Purinones Purinethiones Alkaloids and derivatives Pyrimidones Vinylogous amides Heteroaromatic compounds Ureas Lactams Azacyclic compounds Organic oxides Organic chloride salts Hydrocarbon derivatives Organosulfur compounds Organonitrogen compounds Organooxygen compounds Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Xanthine - Purinethione - Purinone - Alkaloid or derivatives - Pyrimidone - Pyrimidine - Heteroaromatic compound - Vinylogous amide - Lactam - Urea - Azacycle - Organic salt - Organic chloride salt - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Organic cation - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as xanthines. These are purine derivatives with a ketone group conjugated at carbons 2 and 6 of the purine moiety.
External Descriptors
Not available