Vitas-M small molecule compound
7-(2-fluorobenzyl)-1,3-dimethyl-8-[(1H-tetrazol-5-ylmethyl)sulfanyl]-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK667355
SMILES Fc1ccccc1Cn1c(SCc2nnn[nH]2)nc2c1c(=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 C16H15FN8O2S MW 402.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15FN8O2S/c1-23-13-12(14(26)24(2)16(23)27)25(7-9-5-3-4-6-10(9)17)15(18-13)28-8-11-19-21-22-20-11/h3-6H,7-8H2,1-2H3,(H,19,20,21,22)InChIKey
UKXIMEWADWSRQX-UHFFFAOYSA-NSynonyms
7((2FLUOROPHENYL)METHYL)13DIMETHYL8(2HTETRAZOL5YLMETHYLSULFANYL)PURINE26DIONE
7(2fluorobenzyl)13dimethyl8((1Htetrazol5ylmethyl)sulfanyl)37dihydro1Hpurine26dione
7(2FLUOROBENZYL)13DIMETHYL8((1HTETRAZOL5YLMETHYL)THIO)37DIHYDRO1HPURINE26DIONE
7(2FLUOROBENZYL)13DIMETHYL8((2HTETRAZOL5YLMETHYL)SULFANYL)37DIHYDRO1HPURINE26DIONE
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)SCC3=NNN=N3)CC4=CC=CC=C4F
Fc1ccccc1Cn1c(SCc2nnn(nH)2)nc2c1c(=O)n(c(=O)n2C)C
InChI=1SC16H15FN8O2Sc1231312(14(26)24(2)16(23)27)25(79534610(9)17)15(1813)288111921222011h36H78H212H3(H19202122)
MFCD05858228
ZINC000013616211
ZINC13616211
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