Vitas-M small molecule compound
1,3,7-trimethyl-8-({1-[2-oxo-2-(piperidin-1-yl)ethyl]-1H-benzimidazol-2-yl}sulfanyl)-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK765956
SMILES O=C(N1CCCCC1)Cn1c(nc2c1cccc2)Sc1nc2c(n1C)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 C22H25N7O3S MW 467.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25N7O3S/c1-25-17-18(26(2)22(32)27(3)19(17)31)24-20(25)33-21-23-14-9-5-6-10-15(14)29(21)13-16(30)28-11-7-4-8-12-28/h5-6,9-10H,4,7-8,11-13H2,1-3H3InChIKey
XUMRWILQHXFYPK-UHFFFAOYSA-NSynonyms
400070-08-8137trimethyl8((1(2oxo2(piperidin1yl)ethyl)1Hbenzimidazol2yl)sulfanyl)37dihydro1Hpurine26dione
137trimethyl8((1(2oxo2(piperidin1yl)ethyl)1Hbenzo(d)imidazol2yl)thio)1Hpurine26(3H7H)dione
137TRIMETHYL8(1(2OXO2PIPERIDIN1YLETHYL)1HBENZOIMIDAZOL2YLSULFANYL)37DIHYDROPURINE26DIONE
137TRIMETHYL8(1(2OXO2PIPERIDIN1YLETHYL)BENZIMIDAZOL2YL)SULFANYLPURINE26DIONE
400070088
CN1C2=C(N=C1SC3=NC4=CC=CC=C4N3CC(=O)N5CCCCC5)N(C(=O)N(C2=O)C)C
InChI=1SC22H25N7O3Sc1251718(26(2)22(32)27(3)19(17)31)2420(25)332123149561015(14)29(21)1316(30)28117481228h56910H4781113H213H3
MFCD03035820
ZINC000001068451
ZINC01068451
ZINC1068451
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