Vitas-M small molecule compound
methyl [8-(3,5-dimethyl-1H-pyrazol-1-yl)-3-methyl-2,6-dioxo-7-(propan-2-yl)-2,3,6,7-tetrahydro-1H-purin-1-yl]acetate
Catalog ID
STK933756
SMILES COC(=O)Cn1c(=O)n(C)c2c(c1=O)n(C(C)C)c(n2)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 C17H22N6O4 MW 374.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H22N6O4/c1-9(2)22-13-14(18-16(22)23-11(4)7-10(3)19-23)20(5)17(26)21(15(13)25)8-12(24)27-6/h7,9H,8H2,1-6H3InChIKey
GQCWNLKPWMQPCR-UHFFFAOYSA-NSynonyms
1013968-71-21013968712
CC1=CC(=NN1C2=NC3=C(N2C(C)C)C(=O)N(C(=O)N3C)CC(=O)OC)C
InChI=1SC17H22N6O4c19(2)221314(1816(22)2311(4)710(3)1923)20(5)17(26)21(15(13)25)812(24)276h79H8H216H3
methyl(8(35dimethyl1Hpyrazol1yl)3methyl26dioxo7(propan2yl)2367tetrahydro1Hpurin1yl)acetate
methyl2(8(35dimethyl1Hpyrazol1yl)7isopropyl3methyl26dioxo2367tetrahydro1Hpurin1yl)acetate
methyl2(8(35dimethylpyrazol1yl)3methyl26dioxo7propan2ylpurin1yl)acetate
MFCD09978070
ZINC000012231548
ZINC12231548
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