Compound Identification
SMILES
CC(C)CN1C2=C(N(CCN3CCN(CC3)S(=O)(=O)C3=CC=CC=C3)C=N2)C(=O)N(C)C1=O
InChIKey
InChIKey=VOIWCRZQOGNMMJ-UHFFFAOYSA-N
Formula
C22H30N6O4S
Mass
474.58
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 Alkaloids and derivatives Benzenesulfonyl compounds N-alkylpiperazines Pyrimidones N-substituted imidazoles Organosulfonamides Vinylogous amides Heteroaromatic compounds Sulfonyls Lactams Trialkylamines Ureas Azacyclic compounds Organooxygen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Xanthine - 6-oxopurine - Benzenesulfonamide - Purinone - Benzenesulfonyl group - Alkaloid or derivatives - N-alkylpiperazine - Pyrimidone - Monocyclic benzene moiety - 1,4-diazinane - N-substituted imidazole - Piperazine - Benzenoid - Pyrimidine - Organosulfonic acid amide - Azole - Imidazole - Heteroaromatic compound - Vinylogous amide - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Sulfonyl - Lactam - Urea - Tertiary aliphatic amine - Tertiary amine - Azacycle - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Amine - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - 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