Vitas-M small molecule compound
8-[(3-bromobenzyl)sulfanyl]-1,3,7-trimethyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK759357
SMILES Brc1cccc(c1)CSc1nc2c(n1C)c(=O)n(c(=O)n2C)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 C15H15BrN4O2S MW 395.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H15BrN4O2S/c1-18-11-12(19(2)15(22)20(3)13(11)21)17-14(18)23-8-9-5-4-6-10(16)7-9/h4-7H,8H2,1-3H3InChIKey
YVLONOZAJRPKTM-UHFFFAOYSA-NSynonyms
312507-47-4312507474
8((3bromobenzyl)sulfanyl)137trimethyl37dihydro1Hpurine26dione
8((3BROMOBENZYL)SULFANYL)CAFFEINE
8((3bromobenzyl)thio)137trimethyl1Hpurine26(3H7H)dione
8((3BROMOPHENYL)METHYLSULFANYL)137TRIMETHYLPURINE26DIONE
CN1C2=C(N=C1SCC3=CC(=CC=C3)Br)N(C(=O)N(C2=O)C)C
InChI=1SC15H15BrN4O2Sc1181112(19(2)15(22)20(3)13(11)21)1714(18)238954610(16)79h47H8H213H3
MFCD01439840
ZINC000000707576
ZINC00707576
ZINC707576
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