Vitas-M small molecule compound
7-dodecyl-3-methyl-8-(octylsulfanyl)-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK700297
SMILES CCCCCCCCCCCCn1c(SCCCCCCCC)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/c1-4-6-8-10-12-13-14-15-16-18-20-30-22-23(29(3)25(32)28-24(22)31)27-26(30)33-21-19-17-11-9-7-5-2/h4-21H2,1-3H3,(H,28,31,32)InChIKey
RGHUAIWQFVCDDR-UHFFFAOYSA-NSynonyms
329706-03-8329706038
7dodecyl3methyl8(octylsulfanyl)37dihydro1Hpurine26dione
7dodecyl3methyl8(octylthio)1Hpurine26(3H7H)dione
7DODECYL3METHYL8OCTYLSULFANYL37DIHYDROPURINE26DIONE
7DODECYL3METHYL8OCTYLSULFANYLPURINE26DIONE
7DODECYL3METHYL8OCTYLTHIO137TRIHYDROPURINE26DIONE
CCCCCCCCCCCCn1c(SCCCCCCCC)nc2c1c(=O)(nH)c(=O)n2C
CCCCCCCCCCCCN1C2=C(N=C1SCCCCCCCC)N(C(=O)NC2=O)C
InChI=1SC26H46N4O2Sc14681012131415161820302223(29(3)25(32)2824(22)31)2726(30)33211917119752h421H213H3(H283132)
MFCD01143522
ZINC000096019676
ZINC96019676
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