Vitas-M small molecule compound

8-bromo-3-methyl-7-(3-oxobutan-2-yl)-3,7-dihydro-1H-purine-2,6-dione

Catalog ID
STL326291
SMILES CC(=O)C(n1c(Br)nc2c1c(=O)[nH]c(=O)n2C)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 C10H11BrN4O3 MW 315.13 g/mol Purity >90% as per NMR
InChI
InChI=1S/C10H11BrN4O3/c1-4(5(2)16)15-6-7(12-9(15)11)14(3)10(18)13-8(6)17/h4H,1-3H3,(H,13,17,18)
InChIKey
SVSPOEAZYCDBKE-UHFFFAOYSA-N
Synonyms
101072-03-1
101072031
8BROMO3METHYL7(1METHYL2OXOPROPYL)137TRIHYDROPURINE26DIONE
8BROMO3METHYL7(1METHYL2OXOPROPYL)37DIHYDROPURINE26DIONE
8BROMO3METHYL7(3OXOBUTAN2YL)1HPURINE26(3H7H)DIONE
8BROMO3METHYL7(3OXOBUTAN2YL)1HPURINE26DIONE
8bromo3methyl7(3oxobutan2yl)37dihydro1Hpurine26dione
8BROMO3METHYL7(3OXOBUTAN2YL)PURINE26DIONE
CC(=O)C(n1c(Br)nc2c1c(=O)(nH)c(=O)n2C)C
CC(C(=O)C)N1C2=C(N=C1Br)N(C(=O)NC2=O)C
InChI=1SC10H11BrN4O3c14(5(2)16)1567(129(15)11)14(3)10(18)138(6)17h4H13H3(H131718)
MFCD01877929
ZINC000000189494
ZINC000000189497

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Available files

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