Vitas-M small molecule compound
8,8'-(methanediyldisulfanediyl)bis(7-benzyl-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione)
Catalog ID
STK682613
SMILES Cn1c(=O)n(C)c(=O)c2c1nc(n2Cc1ccccc1)SCSc1nc2c(n1Cc1ccccc1)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 C29H28N8O4S2 MW 616.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H28N8O4S2/c1-32-22-20(24(38)34(3)28(32)40)36(15-18-11-7-5-8-12-18)26(30-22)42-17-43-27-31-23-21(25(39)35(4)29(41)33(23)2)37(27)16-19-13-9-6-10-14-19/h5-14H,15-17H2,1-4H3InChIKey
IQWVVCNKQXHWKS-UHFFFAOYSA-NSynonyms
7BENZYL8((7BENZYL13DIMETHYL26DIOXOPURIN8YL)SULFANYLMETHYLSULFANYL)13DIMETHYLPURINE26DIONE
88(methanediyldisulfanediyl)bis(7benzyl13dimethyl37dihydro1Hpurine26dione)
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)SCSC3=NC4=C(N3CC5=CC=CC=C5)C(=O)N(C(=O)N4C)C)CC6=CC=CC=C6
InChI=1SC29H28N8O4S2c1322220(24(38)34(3)28(32)40)36(1518117581218)26(3022)42174327312321(25(39)35(4)29(41)33(23)2)37(27)16191396101419h514H1517H214H3
MFCD03856295
ZINC000098005841
ZINC98005841
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