Vitas-M small molecule compound

8,8'-sulfanediylbis[7-(4-fluorobenzyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione]

Catalog ID
STK540771
SMILES Fc1ccc(cc1)Cn1c(Sc2nc3c(n2Cc2ccc(cc2)F)c(=O)n(c(=O)n3C)C)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 C28H24F2N8O4S MW 606.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H24F2N8O4S/c1-33-21-19(23(39)35(3)27(33)41)37(13-15-5-9-17(29)10-6-15)25(31-21)43-26-32-22-20(24(40)36(4)28(42)34(22)2)38(26)14-16-7-11-18(30)12-8-16/h5-12H,13-14H2,1-4H3
InChIKey
DHHPJYRSYXPMIS-UHFFFAOYSA-N
Synonyms

7((4FLUOROPHENYL)METHYL)8(7((4FLUOROPHENYL)METHYL)13DIMETHYL26DIOXOPURIN8YL)SULFANYL13DIMETHYLPURINE26DIONE
88sulfanediylbis(7(4fluorobenzyl)13dimethyl37dihydro1Hpurine26dione)
88thiobis(7(4fluorobenzyl)13dimethyl1Hpurine26(3H7H)dione)
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)SC3=NC4=C(N3CC5=CC=C(C=C5)F)C(=O)N(C(=O)N4C)C)CC6=CC=C(C=C6)F
InChI=1SC28H24F2N8O4Sc1332119(23(39)35(3)27(33)41)37(13155917(29)10615)25(3121)4326322220(24(40)36(4)28(42)34(22)2)38(26)141671118(30)12816h512H1314H214H3
MFCD02984374
ZINC000005358228
ZINC5358228

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Available files

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