Vitas-M small molecule compound
methyl 2-{2-[5-cyclopropyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]ethyl}-9-methylthieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-8-carboxylate
Catalog ID
STL394183
SMILES COC(=O)c1sc2c(c1C)c1nc(nn1cn2)CCn1nc(cc1C1CC1)C(F)(F)F
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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 C19H17F3N6O2S MW 450.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17F3N6O2S/c1-9-14-16-24-13(26-28(16)8-23-17(14)31-15(9)18(29)30-2)5-6-27-11(10-3-4-10)7-12(25-27)19(20,21)22/h7-8,10H,3-6H2,1-2H3InChIKey
PCGURVDZBAGKIF-UHFFFAOYSA-NSynonyms
1005631-05-91005631059
CC1=C(SC2=C1C3=NC(=NN3C=N2)CCN4C(=CC(=N4)C(F)(F)F)C5CC5)C(=O)OC
InChI=1SC19H17F3N6O2Sc1914162413(2628(16)82317(14)3115(9)18(29)302)562711(103410)712(2527)19(2021)22h7810H36H212H3
METHYL2(2(5CYCLOPROPYL3(TRIFLUOROMETHYL)1HPYRAZOL1YL)ETHYL)9METHYLTHIENO(32E)(124)TRIAZOLO(15C)PYRIMIDINE8CARBOXYLATE
MFCD04135051
ZINC000002804455
ZINC02804455
ZINC2804455
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