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CHEBI:108261 - 7-[2-(1,3-benzothiazol-2-ylthio)ethyl]-1,3-dimethyl-8-(3-methyl-1-piperidinyl)purine-2,6-dione

ChEBI IDCHEBI:108261
ChEBI Name7-[2-(1,3-benzothiazol-2-ylthio)ethyl]-1,3-dimethyl-8-(3-methyl-1-piperidinyl)purine-2,6-dione
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DownloadsMolfile
FormulaC22H26N6O2S2
Net Charge0
Average Mass470.624
Monoisotopic Mass470.15587
SMILESCC1CCCN(c2nc3c(c(=O)n(C)c(=O)n3C)n2CCSc2nc3ccccc3s2)C1
InChIInChI=1S/C22H26N6O2S2/c1-14-7-6-10-27(13-14)20-24-18-17(19(29)26(3)22(30)25(18)2)28(20)11-12-31-21-23-15-8-4-5-9-16(15)32-21/h4-5,8-9,14H,6-7,10-13H2,1-3H3
InChIKeyMFEWOASOCGWVJY-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
7-[2-(1,3-benzothiazol-2-ylthio)ethyl]-1,3-dimethyl-8-(3-methyl-1-piperidinyl)purine-2,6-dione (CHEBI:108261) is a oxopurine (CHEBI:25810)
Manual XrefsDatabases
LSM-19638LINCS