Vitas-M small molecule compound
1-benzyl-8-bromo-3-methyl-7-(2-oxo-2-phenylethyl)-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK529660
SMILES O=C(c1ccccc1)Cn1c(Br)nc2c1c(=O)n(Cc1ccccc1)c(=O)n2C
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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 C21H17BrN4O3 MW 453.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17BrN4O3/c1-24-18-17(19(28)26(21(24)29)12-14-8-4-2-5-9-14)25(20(22)23-18)13-16(27)15-10-6-3-7-11-15/h2-11H,12-13H2,1H3InChIKey
DNUQQXZNYKOIQH-UHFFFAOYSA-NSynonyms
370076-58-71benzyl8bromo3methyl7(2oxo2phenylethyl)1Hpurine26(3H7H)dione
1benzyl8bromo3methyl7(2oxo2phenylethyl)37dihydro1Hpurine26dione
1BENZYL8BROMO3METHYL7PHENACYLPURINE26DIONE
370076587
CN1C2=C(C(=O)N(C1=O)CC3=CC=CC=C3)N(C(=N2)Br)CC(=O)C4=CC=CC=C4
InChI=1SC21H17BrN4O3c1241817(19(28)26(21(24)29)12148425914)25(20(22)2318)1316(27)15106371115h211H1213H21H3
MFCD01555689
ZINC000008934426
ZINC08934426
ZINC8934426
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