Vitas-M small molecule compound
1,3-dimethyl-7-(naphthalen-1-ylmethyl)-8-{[2-(piperidin-1-yl)ethyl]sulfanyl}-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STL004204
SMILES Cn1c(=O)n(C)c(=O)c2c1nc(n2Cc1cccc2c1cccc2)SCCN1CCCCC1
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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 C25H29N5O2S MW 463.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H29N5O2S/c1-27-22-21(23(31)28(2)25(27)32)30(17-19-11-8-10-18-9-4-5-12-20(18)19)24(26-22)33-16-15-29-13-6-3-7-14-29/h4-5,8-12H,3,6-7,13-17H2,1-2H3InChIKey
OIUWYZRPIPEFQO-UHFFFAOYSA-NSynonyms
476480-43-013dimethyl7(naphthalen1ylmethyl)8((2(piperidin1yl)ethyl)sulfanyl)37dihydro1Hpurine26dione
13dimethyl7(naphthalen1ylmethyl)8((2(piperidin1yl)ethyl)thio)1Hpurine26(3H7H)dione
13DIMETHYL7(NAPHTHALEN1YLMETHYL)8(2PIPERIDIN1YLETHYLSULFANYL)PURINE26DIONE
476480430
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)SCCN3CCCCC3)CC4=CC=CC5=CC=CC=C54
InChI=1SC25H29N5O2Sc1272221(23(31)28(2)25(27)32)30(171911810189451220(18)19)24(2622)33161529136371429h45812H3671317H212H3
MFCD03933569
ZINC000009425161
ZINC9425161
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