Vitas-M small molecule compound
8-bromo-3-methyl-7-[2-(3-methyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)ethyl]-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK576549
SMILES Cn1c(=O)[nH]c(=O)c2c1ncn2CCn1c(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 C14H13BrN8O4 MW 437.21 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H13BrN8O4/c1-20-8-6(10(24)18-13(20)26)22(5-16-8)3-4-23-7-9(17-12(23)15)21(2)14(27)19-11(7)25/h5H,3-4H2,1-2H3,(H,18,24,26)(H,19,25,27)InChIKey
AVZROYMZIQMYLQ-UHFFFAOYSA-NSynonyms
372175-68-3372175683
8bromo3methyl7(2(3methyl26dioxo1236tetrahydro7Hpurin7yl)ethyl)37dihydro1Hpurine26dione
8bromo3methyl7(2(3methyl26dioxo23dihydro1Hpurin7(6H)yl)ethyl)1Hpurine26(3H7H)dione
8bromo3methyl7(2(3methyl26dioxopurin7yl)ethyl)purine26dione
Cn1c(=O)(nH)c(=O)c2c1ncn2CCn1c(Br)nc2c1c(=O)(nH)c(=O)n2C
CN1C2=C(C(=O)NC1=O)N(C=N2)CCN3C4=C(N=C3Br)N(C(=O)NC4=O)C
InChI=1SC14H13BrN8O4c12086(10(24)1813(20)26)22(5168)342379(1712(23)15)21(2)14(27)1911(7)25h5H34H212H3(H182426)(H192527)
MFCD00988368
ZINC000008973189
ZINC08973189
ZINC8973189
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