Vitas-M small molecule compound
8-({2-[2-(benzylsulfonyl)-1H-benzimidazol-1-yl]ethyl}sulfanyl)-1,3,7-trimethyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK686115
SMILES Cn1c(SCCn2c3ccccc3nc2S(=O)(=O)Cc2ccccc2)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 C24H24N6O4S2 MW 524.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H24N6O4S2/c1-27-19-20(28(2)24(32)29(3)21(19)31)26-22(27)35-14-13-30-18-12-8-7-11-17(18)25-23(30)36(33,34)15-16-9-5-4-6-10-16/h4-12H,13-15H2,1-3H3InChIKey
CCVCRWAMLLLNCI-UHFFFAOYSA-NSynonyms
8((2(2(benzylsulfonyl)1Hbenzimidazol1yl)ethyl)sulfanyl)137trimethyl37dihydro1Hpurine26dione
8(2(2BENZYLSULFONYLBENZIMIDAZOL1YL)ETHYLSULFANYL)137TRIMETHYLPURINE26DIONE
CN1C2=C(N=C1SCCN3C4=CC=CC=C4N=C3S(=O)(=O)CC5=CC=CC=C5)N(C(=O)N(C2=O)C)C
InChI=1SC24H24N6O4S2c1271920(28(2)24(32)29(3)21(19)31)2622(27)351413301812871117(18)2523(30)36(3334)151695461016h412H1315H213H3
MFCD06014585
ZINC000098007837
ZINC98007837
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