Vitas-M small molecule compound
(8E)-1-(4-bromobenzyl)-3,7-dimethyl-8-[(2E)-(pyridin-4-ylmethylidene)hydrazinylidene]-3,7,8,9-tetrahydro-1H-purine-2,6-dione
Catalog ID
STL057744
SMILES Brc1ccc(cc1)Cn1c(=O)n(C)c2c(c1=O)n(C)/c(=N/N=C/c1ccncc1)/[nH]2
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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 C20H18BrN7O2 MW 468.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18BrN7O2/c1-26-16-17(24-19(26)25-23-11-13-7-9-22-10-8-13)27(2)20(30)28(18(16)29)12-14-3-5-15(21)6-4-14/h3-11H,12H2,1-2H3,(H,24,25)/b23-11+InChIKey
QYFOKXACFRTLQK-FOKLQQMPSA-NSynonyms
714236-31-4(8E)1(4bromobenzyl)37dimethyl8((2E)(pyridin4ylmethylidene)hydrazinylidene)3789tetrahydro1Hpurine26dione
714236314
Brc1ccc(cc1)Cn1c(=O)n(C)c2c(c1=O)n(C)c(=NN=Cc1ccncc1)(nH)2
MFCD05729088
ZINC000009470851
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