Vitas-M small molecule compound
8-bromo-6-hydroxy-3-methyl-7-[2-(pyrimidin-2-ylsulfanyl)ethyl]-3,7-dihydro-2H-purin-2-one
Catalog ID
STK561959
SMILES Oc1nc(=O)n(c2c1n(CCSc1ncccn1)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 C12H11BrN6O2S MW 383.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H11BrN6O2S/c1-18-8-7(9(20)17-12(18)21)19(10(13)16-8)5-6-22-11-14-3-2-4-15-11/h2-4H,5-6H2,1H3,(H,17,20,21)InChIKey
NANRDHMGNGOEQN-UHFFFAOYSA-NSynonyms
476482-16-3476482163
8BROMO3METHYL7(2(PYRIMIDIN2YLTHIO)ETHYL)1HPURINE26(3H7H)DIONE
8BROMO3METHYL7(2PYRIMIDIN2YLSULFANYLETHYL)PURINE26DIONE
8BROMO3METHYL7(2PYRIMIDIN2YLTHIOETHYL)137TRIHYDROPURINE26DIONE
8bromo6hydroxy3methyl7(2(pyrimidin2ylsulfanyl)ethyl)37dihydro2Hpurin2one
CN1C2=C(C(=O)NC1=O)N(C(=N2)Br)CCSC3=NC=CC=N3
InChI=1SC12H11BrN6O2Sc11887(9(20)1712(18)21)19(10(13)168)562211143241511h24H56H21H3(H172021)
MFCD03813498
ZINC000001250997
ZINC01250997
ZINC1250997
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