Compound Identification
SMILES
CCCOC1=C(C=C(C=C1)S(=O)(=O)N1CCN(CCO)CC1)C1=NC2=C(N1)C(=O)N(C)C(=O)N2CC(C)C
InChIKey
InChIKey=BAIYMQQYOWFETE-UHFFFAOYSA-N
Formula
C25H36N6O6S
Mass
548.66
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
Phenylimidazoles Benzenesulfonamides 6-oxopurines Benzenesulfonyl compounds Alkaloids and derivatives Phenoxy compounds Phenol ethers Alkyl aryl ethers Pyrimidones N-alkylpiperazines Organosulfonamides Vinylogous amides Heteroaromatic compounds Sulfonyls Trialkylamines Ureas Lactams 1,2-aminoalcohols Azacyclic compounds Hydrocarbon derivatives Organic oxides Primary alcohols
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-phenylimidazole - Xanthine - 6-oxopurine - Benzenesulfonamide - Purinone - Benzenesulfonyl group - Alkaloid or derivatives - Phenoxy compound - Phenol ether - Alkyl aryl ether - Pyrimidone - N-alkylpiperazine - Monocyclic benzene moiety - 1,4-diazinane - Piperazine - Pyrimidine - Organosulfonic acid amide - Benzenoid - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Vinylogous amide - Heteroaromatic compound - Sulfonyl - Azole - Imidazole - Urea - Tertiary aliphatic amine - Tertiary amine - 1,2-aminoalcohol - Lactam - Alkanolamine - Azacycle - Ether - Amine - Organic nitrogen compound - Organic oxide - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Organosulfur compound - Hydrocarbon derivative - Alcohol - Primary alcohol - 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