Vitas-M small molecule compound
8-(dodecylsulfanyl)-3-methyl-7-(3-phenylpropyl)-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK527040
SMILES CCCCCCCCCCCCSc1nc2c(n1CCCc1ccccc1)c(=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 C27H40N4O2S MW 484.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H40N4O2S/c1-3-4-5-6-7-8-9-10-11-15-21-34-27-28-24-23(25(32)29-26(33)30(24)2)31(27)20-16-19-22-17-13-12-14-18-22/h12-14,17-18H,3-11,15-16,19-21H2,1-2H3,(H,29,32,33)InChIKey
UQKPBVCPVGFARP-UHFFFAOYSA-NSynonyms
371781-74-7371781747
8(dodecylsulfanyl)3methyl7(3phenylpropyl)37dihydro1Hpurine26dione
8(dodecylthio)3methyl7(3phenylpropyl)1Hpurine26(3H7H)dione
8DODECYLSULFANYL3METHYL7(3PHENYLPROPYL)37DIHYDROPURINE26DIONE
8DODECYLSULFANYL3METHYL7(3PHENYLPROPYL)PURINE26DIONE
8DODECYLTHIO3METHYL7(3PHENYLPROPYL)137TRIHYDROPURINE26DIONE
CCCCCCCCCCCCSC1=NC2=C(N1CCCC3=CC=CC=C3)C(=O)NC(=O)N2C
CCCCCCCCCCCCSc1nc2c(n1CCCc1ccccc1)c(=O)(nH)c(=O)n2C
InChI=1SC27H40N4O2Sc13456789101115213427282423(25(32)2926(33)30(24)2)31(27)20161922171312141822h12141718H31115161921H212H3(H293233)
MFCD01032171
ZINC000100692155
ZINC100692155
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