Vitas-M small molecule compound
8-(hexylsulfanyl)-3-methyl-7-(3-methylbenzyl)-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK834370
SMILES CCCCCCSc1nc2c(n1Cc1cccc(c1)C)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 C20H26N4O2S MW 386.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H26N4O2S/c1-4-5-6-7-11-27-20-21-17-16(18(25)22-19(26)23(17)3)24(20)13-15-10-8-9-14(2)12-15/h8-10,12H,4-7,11,13H2,1-3H3,(H,22,25,26)InChIKey
NQUHFDGDJFAMCY-UHFFFAOYSA-NSynonyms
303973-32-2303973322
8(hexylsulfanyl)3methyl7(3methylbenzyl)37dihydro1Hpurine26dione
8(hexylthio)3methyl7(3methylbenzyl)1Hpurine26(3H7H)dione
8HEXYLSULFANYL3METHYL7((3METHYLPHENYL)METHYL)PURINE26DIONE
8HEXYLSULFANYL3METHYL7(3METHYLBENZYL)37DIHYDROPURINE26DIONE
8HEXYLTHIO3METHYL7((3METHYLPHENYL)METHYL)137TRIHYDROPURINE26DIONE
CCCCCCSC1=NC2=C(N1CC3=CC=CC(=C3)C)C(=O)NC(=O)N2C
CCCCCCSc1nc2c(n1Cc1cccc(c1)C)c(=O)(nH)c(=O)n2C
InChI=1SC20H26N4O2Sc14567112720211716(18(25)2219(26)23(17)3)24(20)1315108914(2)1215h81012H471113H213H3(H222526)
MFCD01186384
ZINC000002060836
ZINC02060836
ZINC2060836
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