Vitas-M small molecule compound
8-(benzylsulfanyl)-7-butyl-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK099800
SMILES CCCCn1c(SCc2ccccc2)nc2c1c(=O)[nH]c(=O)n2C
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C17H20N4O2S MW 344.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H20N4O2S/c1-3-4-10-21-13-14(20(2)16(23)19-15(13)22)18-17(21)24-11-12-8-6-5-7-9-12/h5-9H,3-4,10-11H2,1-2H3,(H,19,22,23)InChIKey
GVRMXAAJDRWFIL-UHFFFAOYSA-NSynonyms
303968-90-3303968903
7BUTYL3METHYL8(PHENYLMETHYLTHIO)137TRIHYDROPURINE26DIONE
8(BENZYLSULFANYL)7BUTYL3METHYL37DIHYDRO1HPURINE26DIONE
8(BENZYLSULFANYL)7BUTYL6HYDROXY3METHYL37DIHYDRO2HPURIN2ONE
8(BENZYLTHIO)7BUTYL3METHYL1HPURINE26(3H7H)DIONE
8BENZYLSULFANYL7BUTYL3METHYL37DIHYDROPURINE26DIONE
8BENZYLSULFANYL7BUTYL3METHYLPURINE26DIONE
CCCCn1c(SCc2ccccc2)nc2c1c(=O)(nH)c(=O)n2C
CCCCN1C2=C(N=C1SCC3=CC=CC=C3)N(C(=O)NC2=O)C
InChI=1SC17H20N4O2Sc13410211314(20(2)16(23)1915(13)22)1817(21)2411128657912h59H341011H212H3(H192223)
MFCD01556520
STK099800
ZINC01818387
ZINC1818387
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