Vitas-M small molecule compound
8-[benzyl(methyl)amino]-1,3-dimethyl-7-{2-[(4-methylpyrimidin-2-yl)sulfanyl]ethyl}-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK852034
SMILES Cc1ccnc(n1)SCCn1c(nc2c1c(=O)n(C)c(=O)n2C)N(Cc1ccccc1)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 C22H25N7O2S MW 451.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25N7O2S/c1-15-10-11-23-20(24-15)32-13-12-29-17-18(27(3)22(31)28(4)19(17)30)25-21(29)26(2)14-16-8-6-5-7-9-16/h5-11H,12-14H2,1-4H3InChIKey
CTOXESMZUNUJRS-UHFFFAOYSA-NSynonyms
838893-79-113DIMETHYL8(METHYLBENZYLAMINO)7(2(4METHYLPYRIMIDIN2YLTHIO)ETHYL)137TRIHYDROPURINE26DIONE
8(benzyl(methyl)amino)13dimethyl7(2((4methylpyrimidin2yl)sulfanyl)ethyl)37dihydro1Hpurine26dione
8(BENZYL(METHYL)AMINO)13DIMETHYL7(2((4METHYLPYRIMIDIN2YL)THIO)ETHYL)1HPURINE26(3H7H)DIONE
8(BENZYL(METHYL)AMINO)13DIMETHYL7(2(4METHYLPYRIMIDIN2YL)SULFANYLETHYL)PURINE26DIONE
838893791
CC1=NC(=NC=C1)SCCN2C3=C(N=C2N(C)CC4=CC=CC=C4)N(C(=O)N(C3=O)C)C
InChI=1SC22H25N7O2Sc11510112320(2415)321312291718(27(3)22(31)28(4)19(17)30)2521(29)26(2)14168657916h511H1214H214H3
MFCD04456973
ZINC000006529274
ZINC06529274
ZINC6529274
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