Vitas-M small molecule compound
dimethyl 2,2'-(8-bromo-3-methyl-2,6-dioxo-3,6-dihydro-1H-purine-1,7(2H)-diyl)diacetate
Catalog ID
STK838185
SMILES COC(=O)Cn1c(Br)nc2c1c(=O)n(CC(=O)OC)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 C12H13BrN4O6 MW 389.16 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H13BrN4O6/c1-15-9-8(16(11(13)14-9)4-6(18)22-2)10(20)17(12(15)21)5-7(19)23-3/h4-5H2,1-3H3InChIKey
JHLJCNYFVWPQQL-UHFFFAOYSA-NSynonyms
332905-15-4332905154
CN1C2=C(C(=O)N(C1=O)CC(=O)OC)N(C(=N2)Br)CC(=O)OC
DIMETHYL22(8BROMO3METHYL26DIOXO23DIHYDRO1HPURINE17(6H)DIYL)DIACETATE
dimethyl22(8bromo3methyl26dioxo36dihydro1Hpurine17(2H)diyl)diacetate
InChI=1SC12H13BrN4O6c11598(16(11(13)149)46(18)222)10(20)17(12(15)21)57(19)233h45H213H3
METHYL2(8BROMO1((METHOXYCARBONYL)METHYL)3METHYL26DIOXO137TRIHYDROPURIN7YL)ACETATE
METHYL2(8BROMO1(2METHOXY2OXOETHYL)3METHYL26DIOXOPURIN7YL)ACETATE
MFCD01948624
ZINC000000976502
ZINC00976502
ZINC976502
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