Vitas-M small molecule compound
methyl 7-[4-methyl-2-(pyrrolidin-1-yl)pyrimidin-5-yl]-2-(methylsulfanyl)[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
Catalog ID
STL508626
SMILES COC(=O)c1cnc2n(c1c1cnc(nc1C)N1CCCC1)nc(n2)SC
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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 C17H19N7O2S MW 385.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H19N7O2S/c1-10-11(8-18-15(20-10)23-6-4-5-7-23)13-12(14(25)26-2)9-19-16-21-17(27-3)22-24(13)16/h8-9H,4-7H2,1-3H3InChIKey
CXYKIHYOLVMSFX-UHFFFAOYSA-NSynonyms
132452610
InChI=1SC17H19N7O2Sc11011(81815(2010)23645723)1312(14(25)262)919162117(273)2224(13)16h89H47H213H3
methyl7(4methyl2(pyrrolidin1yl)pyrimidin5yl)2(methylsulfanyl)(124)triazolo(15a)pyrimidine6carboxylate
methyl7(4methyl2pyrrolidin1ylpyrimidin5yl)2methylsulfanyl(124)triazolo(15a)pyrimidine6carboxylate
MFCD31614973
ZINC000618255994
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