Vitas-M small molecule compound
8-[(4-bromo-2-fluorobenzyl)sulfanyl]-9-methyl-1,9-dihydro-6H-purin-6-one
Catalog ID
STK497001
SMILES Brc1ccc(c(c1)F)CSc1nc2c(n1C)nc[nH]c2=O
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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 C13H10BrFN4OS MW 369.22 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H10BrFN4OS/c1-19-11-10(12(20)17-6-16-11)18-13(19)21-5-7-2-3-8(14)4-9(7)15/h2-4,6H,5H2,1H3,(H,16,17,20)InChIKey
ZSHVWDWUURRQHO-UHFFFAOYSA-NSynonyms
8((4bromo2fluorobenzyl)sulfanyl)9methyl19dihydro6Hpurin6one
8((4bromo2fluorophenyl)methylsulfanyl)9methyl3Hpurin6one
8((4BROMO2FLUOROPHENYL)METHYLTHIO)9METHYLHYDROPURIN6ONE
Brc1ccc(c(c1)F)CSc1nc2c(n1C)nc(nH)c2=O
CN1C2=C(C(=O)N=CN2)N=C1SCC3=C(C=C(C=C3)Br)F
InChI=1SC13H10BrFN4OSc1191110(12(20)1761611)1813(19)2157238(14)49(7)15h246H5H21H3(H161720)
MFCD09788402
ZINC000012427873
ZINC12427873
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