Vitas-M small molecule compound
1,3-dimethyl-8-(4-methylpiperidin-1-yl)-7-{2-[(4-methylpyrimidin-2-yl)sulfanyl]ethyl}-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK848365
SMILES CC1CCN(CC1)c1nc2c(n1CCSc1nccc(n1)C)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 C20H27N7O2S MW 429.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H27N7O2S/c1-13-6-9-26(10-7-13)19-23-16-15(17(28)25(4)20(29)24(16)3)27(19)11-12-30-18-21-8-5-14(2)22-18/h5,8,13H,6-7,9-12H2,1-4H3InChIKey
GIZBPVWMJNMGLS-UHFFFAOYSA-NSynonyms
850914-62-413dimethyl8(4methylpiperidin1yl)7(2((4methylpyrimidin2yl)sulfanyl)ethyl)37dihydro1Hpurine26dione
13DIMETHYL8(4METHYLPIPERIDIN1YL)7(2((4METHYLPYRIMIDIN2YL)THIO)ETHYL)1HPURINE26(3H7H)DIONE
13DIMETHYL8(4METHYLPIPERIDIN1YL)7(2(4METHYLPYRIMIDIN2YL)SULFANYLETHYL)PURINE26DIONE
13DIMETHYL8(4METHYLPIPERIDYL)7(2(4METHYLPYRIMIDIN2YLTHIO)ETHYL)137TRIHYDROPURINE26DIONE
850914624
CC1CCN(CC1)C2=NC3=C(N2CCSC4=NC=CC(=N4)C)C(=O)N(C(=O)N3C)C
InChI=1SC20H27N7O2Sc1136926(10713)19231615(17(28)25(4)20(29)24(16)3)27(19)11123018218514(2)2218h5813H67912H214H3
MFCD04456934
ZINC000002354405
ZINC02354405
ZINC2354405
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