Vitas-M small molecule compound
7-[2-(benzylamino)ethyl]-8-bromo-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STL322287
SMILES O=c1[nH]c(=O)n(c2c1n(CCNCc1ccccc1)c(n2)Br)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 C15H16BrN5O2 MW 378.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H16BrN5O2/c1-20-12-11(13(22)19-15(20)23)21(14(16)18-12)8-7-17-9-10-5-3-2-4-6-10/h2-6,17H,7-9H2,1H3,(H,19,22,23)InChIKey
KIQPTLILOFXJKL-UHFFFAOYSA-NSynonyms
304880-35-1304880351
7(2(benzylamino)ethyl)8bromo3methyl1Hpurine26(3H7H)dione
7(2(benzylamino)ethyl)8bromo3methyl37dihydro1Hpurine26dione
7(2(BENZYLAMINO)ETHYL)8BROMO3METHYLPURINE26DIONE
CN1C2=C(C(=O)NC1=O)N(C(=N2)Br)CCNCC3=CC=CC=C3
InChI=1SC15H16BrN5O2c1201211(13(22)1915(20)23)21(14(16)1812)87179105324610h2617H79H21H3(H192223)
MFCD00845781
O=c1(nH)c(=O)n(c2c1n(CCNCc1ccccc1)c(n2)Br)C
ZINC000006208840
ZINC6208840
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