Vitas-M small molecule compound
1-benzyl-8-(3,5-dimethyl-1H-pyrazol-1-yl)-7-(2-methoxyethyl)-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK934942
SMILES COCCn1c(nc2c1c(=O)n(Cc1ccccc1)c(=O)n2C)n1nc(cc1C)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 C21H24N6O3 MW 408.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N6O3/c1-14-12-15(2)27(23-14)20-22-18-17(25(20)10-11-30-4)19(28)26(21(29)24(18)3)13-16-8-6-5-7-9-16/h5-9,12H,10-11,13H2,1-4H3InChIKey
HDZYKHCKPGLZKB-UHFFFAOYSA-NSynonyms
1014031-07-21014031072
1BENZYL8(35DIMETHYL1HPYRAZOL1YL)7(2METHOXYETHYL)3METHYL1HPURINE26(3H7H)DIONE
1benzyl8(35dimethyl1Hpyrazol1yl)7(2methoxyethyl)3methyl37dihydro1Hpurine26dione
1benzyl8(35dimethylpyrazol1yl)7(2methoxyethyl)3methylpurine26dione
CC1=CC(=NN1C2=NC3=C(N2CCOC)C(=O)N(C(=O)N3C)CC4=CC=CC=C4)C
InChI=1SC21H24N6O3c1141215(2)27(2314)20221817(25(20)1011304)19(28)26(21(29)24(18)3)13168657916h5912H101113H214H3
MFCD09978169
ZINC000012231840
ZINC12231840
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