Vitas-M small molecule compound
8-bromo-6-hydroxy-3-methyl-7-{2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]ethyl}-3,7-dihydro-2H-purin-2-one
Catalog ID
STL038487
SMILES Oc1nc(=O)n(c2c1n(CCSc1nnnn1c1ccccc1)c(n2)Br)C
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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 C15H13BrN8O2S MW 449.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H13BrN8O2S/c1-22-11-10(12(25)18-14(22)26)23(13(16)17-11)7-8-27-15-19-20-21-24(15)9-5-3-2-4-6-9/h2-6H,7-8H2,1H3,(H,18,25,26)InChIKey
WXLVSTYTWXLHIA-UHFFFAOYSA-NSynonyms
671758-55-7671758557
8BROMO3METHYL7(2(1PHENYLTETRAZOL5YL)SULFANYLETHYL)PURINE26DIONE
8bromo6hydroxy3methyl7(2((1phenyl1Htetrazol5yl)sulfanyl)ethyl)37dihydro2Hpurin2one
CN1C2=C(C(=O)NC1=O)N(C(=N2)Br)CCSC3=NN=NN3C4=CC=CC=C4
InChI=1SC15H13BrN8O2Sc1221110(12(25)1814(22)26)23(13(16)1711)78271519202124(15)9532469h26H78H21H3(H182526)
MFCD03799333
ZINC000001301142
ZINC01301142
ZINC1301142
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