Vitas-M small molecule compound
8-(butylsulfanyl)-7-hexyl-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK805914
SMILES CCCCCCn1c(SCCCC)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 C16H26N4O2S MW 338.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H26N4O2S/c1-4-6-8-9-10-20-12-13(17-16(20)23-11-7-5-2)19(3)15(22)18-14(12)21/h4-11H2,1-3H3,(H,18,21,22)InChIKey
XXJNPWIAAJTFLH-UHFFFAOYSA-NSynonyms
332033-49-5332033495
8(butylsulfanyl)7hexyl3methyl37dihydro1Hpurine26dione
8(butylthio)7hexyl3methyl1Hpurine26(3H7H)dione
8BUTYLSULFANYL7HEXYL3METHYL37DIHYDROPURINE26DIONE
8BUTYLSULFANYL7HEXYL3METHYLPURINE26DIONE
8BUTYLTHIO7HEXYL3METHYL137TRIHYDROPURINE26DIONE
CCCCCCn1c(SCCCC)nc2c1c(=O)(nH)c(=O)n2C
CCCCCCN1C2=C(N=C1SCCCC)N(C(=O)NC2=O)C
InChI=1SC16H26N4O2Sc1468910201213(1716(20)2311752)19(3)15(22)1814(12)21h411H213H3(H182122)
MFCD01186341
ZINC000002060818
ZINC02060818
ZINC2060818
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