Vitas-M small molecule compound

methyl (8-bromo-3-methyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetate

Catalog ID
STL328140
SMILES COC(=O)Cn1c(Br)nc2c1c(=O)[nH]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 C9H9BrN4O4 MW 317.10 g/mol Purity >90% as per NMR
InChI
InChI=1S/C9H9BrN4O4/c1-13-6-5(7(16)12-9(13)17)14(8(10)11-6)3-4(15)18-2/h3H2,1-2H3,(H,12,16,17)
InChIKey
LNXRCUPPSGZYJI-UHFFFAOYSA-N
Synonyms
332388-35-9
332388359
CN1C2=C(C(=O)NC1=O)N(C(=N2)Br)CC(=O)OC
COC(=O)Cn1c(Br)nc2c1c(=O)(nH)c(=O)n2C
InChI=1SC9H9BrN4O4c11365(7(16)129(13)17)14(8(10)116)34(15)182h3H212H3(H121617)
methyl(8bromo3methyl26dioxo1236tetrahydro7Hpurin7yl)acetate
METHYL2(8BROMO3METHYL26DIOXO137TRIHYDROPURIN7YL)ACETATE
METHYL2(8BROMO3METHYL26DIOXO23DIHYDRO1HPURIN7(6H)YL)ACETATE
METHYL2(8BROMO3METHYL26DIOXOPURIN7YL)ACETATE
MFCD01959172
ZINC000000380541
ZINC00380541
ZINC380541

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Available files

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