Vitas-M small molecule compound
8-bromo-7-{(2E)-2-[(2Z)-{7-[2-hydroxy-3-(2-methylphenoxy)propyl]-1,3-dimethyl-2,6-dioxo-1,2,3,6,7,9-hexahydro-8H-purin-8-ylidene}hydrazinylidene]ethyl}-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK586105
SMILES OC(Cn1/c(=N\N=C\Cn2c(Br)nc3c2c(=O)n(C)c(=O)n3C)/[nH]c2c1c(=O)n(c(=O)n2C)C)COc1ccccc1C
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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 C26H29BrN10O6 MW 657.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H29BrN10O6/c1-14-8-6-7-9-16(14)43-13-15(38)12-37-18-20(33(3)26(42)35(5)22(18)40)30-24(37)31-28-10-11-36-17-19(29-23(36)27)32(2)25(41)34(4)21(17)39/h6-10,15,38H,11-13H2,1-5H3,(H,30,31)/b28-10+InChIKey
JKHGHRXUXDGJGO-ORBVJSQLSA-NSynonyms
850188-53-3850188533
8bromo7((2E)2((2Z)(7(2hydroxy3(2methylphenoxy)propyl)13dimethyl26dioxo123679hexahydro8Hpurin8ylidene)hydrazinylidene)ethyl)13dimethyl37dihydro1Hpurine26dione
MFCD18158293
OC(Cn1c(=NN=CCn2c(Br)nc3c2c(=O)n(C)c(=O)n3C)(nH)c2c1c(=O)n(c(=O)n2C)C)COc1ccccc1C
ZINC000097957045
ZINC000097957046
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