Vitas-M small molecule compound
7-(3-bromobenzyl)-8-[(2-hydroxyethyl)sulfanyl]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK528278
SMILES OCCSc1nc2c(n1Cc1cccc(c1)Br)c(=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 C15H15BrN4O3S MW 411.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H15BrN4O3S/c1-19-12-11(13(22)18-14(19)23)20(15(17-12)24-6-5-21)8-9-3-2-4-10(16)7-9/h2-4,7,21H,5-6,8H2,1H3,(H,18,22,23)InChIKey
OQLZYNAZSMDWNH-UHFFFAOYSA-NSynonyms
316359-42-9316359429
7((3BROMOPHENYL)METHYL)8(2HYDROXYETHYLSULFANYL)3METHYLPURINE26DIONE
7(3bromobenzyl)8((2hydroxyethyl)sulfanyl)3methyl37dihydro1Hpurine26dione
7(3bromobenzyl)8((2hydroxyethyl)thio)3methyl1Hpurine26(3H7H)dione
CN1C2=C(C(=O)NC1=O)N(C(=N2)SCCO)CC3=CC(=CC=C3)Br
InChI=1SC15H15BrN4O3Sc1191211(13(22)1814(19)23)20(15(1712)246521)8932410(16)79h24721H568H21H3(H182223)
MFCD01557434
OCCSc1nc2c(n1Cc1cccc(c1)Br)c(=O)(nH)c(=O)n2C
ZINC000002362011
ZINC02362011
ZINC2362011
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