Compound Identification
SMILES
CCCCN1C2=C(N(C=N2)S(=O)(=O)C2=CC(OC)=C(OC)C=C2)C(=O)NC1=O
InChIKey
InChIKey=LSLCLFOSECWTPV-UHFFFAOYSA-N
Formula
C17H20N4O6S
Mass
408.43
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 Xanthines
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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
Xanthines
Alternative Parents
6-oxopurines Benzenesulfonamides Dimethoxybenzenes Alkaloids and derivatives Benzenesulfonyl compounds Anisoles Phenoxy compounds Pyrimidones Alkyl aryl ethers N-substituted imidazoles Heteroaromatic compounds Sulfonyls Vinylogous amides Organosulfonic acids and derivatives Lactams Ureas Azacyclic compounds Organic oxides Hydrocarbon derivatives Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Xanthine - 6-oxopurine - Purinone - Dimethoxybenzene - O-dimethoxybenzene - Benzenesulfonamide - Benzenesulfonyl group - Alkaloid or derivatives - Methoxybenzene - Anisole - Phenol ether - Phenoxy compound - Pyrimidone - Alkyl aryl ether - Pyrimidine - Benzenoid - N-substituted imidazole - Monocyclic benzene moiety - Azole - Heteroaromatic compound - Imidazole - Vinylogous amide - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Lactam - Urea - Azacycle - Ether - Organonitrogen compound - Organic oxide - Organooxygen compound - Organosulfur compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxygen compound - 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