Vitas-M small molecule compound
methyl [3-methyl-2,6-dioxo-7-(propan-2-yl)-8-(3,4,5-trimethyl-1H-pyrazol-1-yl)-2,3,6,7-tetrahydro-1H-purin-1-yl]acetate
Catalog ID
STK941762
SMILES COC(=O)Cn1c(=O)c2n(C(C)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 C18H24N6O4 MW 388.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H24N6O4/c1-9(2)23-14-15(19-17(23)24-12(5)10(3)11(4)20-24)21(6)18(27)22(16(14)26)8-13(25)28-7/h9H,8H2,1-7H3InChIKey
LBEFBKJSMIHBSB-UHFFFAOYSA-NSynonyms
1014011-38-11014011381
CC1=C(N(N=C1C)C2=NC3=C(N2C(C)C)C(=O)N(C(=O)N3C)CC(=O)OC)C
InChI=1SC18H24N6O4c19(2)231415(1917(23)2412(5)10(3)11(4)2024)21(6)18(27)22(16(14)26)813(25)287h9H8H217H3
methyl(3methyl26dioxo7(propan2yl)8(345trimethyl1Hpyrazol1yl)2367tetrahydro1Hpurin1yl)acetate
methyl2(3methyl26dioxo7propan2yl8(345trimethylpyrazol1yl)purin1yl)acetate
methyl2(7isopropyl3methyl26dioxo8(345trimethyl1Hpyrazol1yl)2367tetrahydro1Hpurin1yl)acetate
MFCD09978236
ZINC000012232025
ZINC12232025
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