Vitas-M small molecule compound
8-bromo-6-hydroxy-3-methyl-7-{2-[(4-methylpyrimidin-2-yl)sulfanyl]ethyl}-3,7-dihydro-2H-purin-2-one
Catalog ID
STL048378
SMILES Cc1ccnc(n1)SCCn1c(Br)nc2c1c(O)nc(=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 C13H13BrN6O2S MW 397.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H13BrN6O2S/c1-7-3-4-15-12(16-7)23-6-5-20-8-9(17-11(20)14)19(2)13(22)18-10(8)21/h3-4H,5-6H2,1-2H3,(H,18,21,22)InChIKey
VNBWNUCDUOJCPU-UHFFFAOYSA-NSynonyms
714284-58-9714284589
8BROMO3METHYL7(2((4METHYLPYRIMIDIN2YL)THIO)ETHYL)1HPURINE26(3H7H)DIONE
8BROMO3METHYL7(2(4METHYLPYRIMIDIN2YL)SULFANYLETHYL)PURINE26DIONE
8BROMO3METHYL7(2(4METHYLPYRIMIDIN2YLTHIO)ETHYL)137TRIHYDROPURINE26DIONE
8bromo6hydroxy3methyl7(2((4methylpyrimidin2yl)sulfanyl)ethyl)37dihydro2Hpurin2one
CC1=NC(=NC=C1)SCCN2C3=C(N=C2Br)N(C(=O)NC3=O)C
InChI=1SC13H13BrN6O2Sc17341512(167)23652089(1711(20)14)19(2)13(22)1810(8)21h34H56H212H3(H182122)
MFCD05726209
ZINC000001292400
ZINC01292400
ZINC1292400
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