Vitas-M small molecule compound
1-benzyl-8-(3,5-dimethyl-1H-pyrazol-1-yl)-3-methyl-7-(2-methylpropyl)-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK931882
SMILES CC(Cn1c(nc2c1c(=O)n(Cc1ccccc1)c(=O)n2C)n1nc(cc1C)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 C22H26N6O2 MW 406.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26N6O2/c1-14(2)12-26-18-19(23-21(26)28-16(4)11-15(3)24-28)25(5)22(30)27(20(18)29)13-17-9-7-6-8-10-17/h6-11,14H,12-13H2,1-5H3InChIKey
CBZUKPRXAFZXCJ-UHFFFAOYSA-NSynonyms
1020453-97-71020453977
1benzyl8(35dimethyl1Hpyrazol1yl)3methyl7(2methylpropyl)37dihydro1Hpurine26dione
1BENZYL8(35DIMETHYL1HPYRAZOL1YL)7ISOBUTYL3METHYL1HPURINE26(3H7H)DIONE
1benzyl8(35dimethylpyrazol1yl)3methyl7(2methylpropyl)purine26dione
CC1=CC(=NN1C2=NC3=C(N2CC(C)C)C(=O)N(C(=O)N3C)CC4=CC=CC=C4)C
InChI=1SC22H26N6O2c114(2)12261819(2321(26)2816(4)1115(3)2428)25(5)22(30)27(20(18)29)131797681017h61114H1213H215H3
MFCD09978084
ZINC000012231588
ZINC12231588
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