Vitas-M small molecule compound
methyl [3,7-dimethyl-2,6-dioxo-8-(3,4,5-trimethyl-1H-pyrazol-1-yl)-2,3,6,7-tetrahydro-1H-purin-1-yl]acetate
Catalog ID
STK933196
SMILES COC(=O)Cn1c(=O)c2n(C)c(nc2n(c1=O)C)n1nc(c(c1C)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 C16H20N6O4 MW 360.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H20N6O4/c1-8-9(2)18-22(10(8)3)15-17-13-12(19(15)4)14(24)21(7-11(23)26-6)16(25)20(13)5/h7H2,1-6H3InChIKey
MGAZGUFGPOWGOE-UHFFFAOYSA-NSynonyms
1013971-84-01013971840
CC1=C(N(N=C1C)C2=NC3=C(N2C)C(=O)N(C(=O)N3C)CC(=O)OC)C
InChI=1SC16H20N6O4c189(2)1822(10(8)3)15171312(19(15)4)14(24)21(711(23)266)16(25)20(13)5h7H216H3
methyl(37dimethyl26dioxo8(345trimethyl1Hpyrazol1yl)2367tetrahydro1Hpurin1yl)acetate
methyl2(37dimethyl26dioxo8(345trimethyl1Hpyrazol1yl)2367tetrahydro1Hpurin1yl)acetate
methyl2(37dimethyl26dioxo8(345trimethylpyrazol1yl)purin1yl)acetate
MFCD09978212
ZINC000012231957
ZINC12231957
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