Vitas-M small molecule compound

8-chloro-1,3-dimethyl-7-(prop-2-yn-1-yl)-3,7-dihydro-1H-purine-2,6-dione

Catalog ID
STK677061
SMILES C#CCn1c(Cl)nc2c1c(=O)n(C)c(=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 C10H9ClN4O2 MW 252.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C10H9ClN4O2/c1-4-5-15-6-7(12-9(15)11)13(2)10(17)14(3)8(6)16/h1H,5H2,2-3H3
InChIKey
KRYYCCSOGGVNKO-UHFFFAOYSA-N
Synonyms
109981-15-9
109981159
1HPURINE26DIONE37DIHYDRO8CHLORO13DIMETHYL7(2PROPYNYL)
8CHLORO13DIMETHYL7(2PROPYNYL)37DIHYDRO1HPURINE26DIONE
8chloro13dimethyl7(prop2yn1yl)37dihydro1Hpurine26dione
8CHLORO13DIMETHYL7PROP2YNYL137TRIHYDROPURINE26DIONE
8CHLORO13DIMETHYL7PROP2YNYLPURINE26DIONE
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)Cl)CC#C
InChI=1SC10H9ClN4O2c1451567(129(15)11)13(2)10(17)14(3)8(6)16h1H5H223H3
MFCD02327160
ZINC000000053720
ZINC00053720
ZINC53720

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Available files

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