Vitas-M small molecule compound

8-[(1E)-3,3-dimethyltriaz-1-en-1-yl]-1,3-dimethyl-3,9-dihydro-1H-purine-2,6-dione

Catalog ID
STK651468
SMILES CN(/N=N/c1nc2c([nH]1)n(C)c(=O)n(c2=O)C)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 C9H13N7O2 MW 251.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C9H13N7O2/c1-14(2)13-12-8-10-5-6(11-8)15(3)9(18)16(4)7(5)17/h1-4H3,(H,10,11)/b13-12+
InChIKey
XSMQMOYXSNWSHW-OUKQBFOZSA-N
Synonyms
85609-71-8
(E)8(33dimethyltriaz1en1yl)13dimethyl1Hpurine26(3H7H)dione
8((1E)33dimethyltriaz1en1yl)13dimethyl39dihydro1Hpurine26dione
85609718
CN(N=Nc1(nH)c2c(n1)n(C)c(=O)n(c2=O)C)C
CN(N=Nc1nc2c((nH)1)n(C)c(=O)n(c2=O)C)C
MFCD18165988
ZINC000100012150

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Available files

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