Vitas-M small molecule compound
8-(butylsulfanyl)-7-hexadecyl-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK527952
SMILES CCCCCCCCCCCCCCCCn1c(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 C26H46N4O2S MW 478.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H46N4O2S/c1-4-6-8-9-10-11-12-13-14-15-16-17-18-19-20-30-22-23(27-26(30)33-21-7-5-2)29(3)25(32)28-24(22)31/h4-21H2,1-3H3,(H,28,31,32)InChIKey
JMJJBLURYKDLNM-UHFFFAOYSA-NSynonyms
330180-43-3330180433
8(butylsulfanyl)7hexadecyl3methyl37dihydro1Hpurine26dione
8(butylthio)7hexadecyl3methyl1Hpurine26(3H7H)dione
8BUTYLSULFANYL7HEXADECYL3METHYLPURINE26DIONE
8BUTYLTHIO7HEXADECYL3METHYL137TRIHYDROPURINE26DIONE
CCCCCCCCCCCCCCCCn1c(SCCCC)nc2c1c(=O)(nH)c(=O)n2C
CCCCCCCCCCCCCCCCN1C2=C(N=C1SCCCC)N(C(=O)NC2=O)C
InChI=1SC26H46N4O2Sc146891011121314151617181920302223(2726(30)3321752)29(3)25(32)2824(22)31h421H213H3(H283132)
MFCD01017638
ZINC000096019694
ZINC96019694
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