Vitas-M small molecule compound
9-tert-butyl-2-{[3-(difluoromethyl)-5-methyl-1H-pyrazol-1-yl]methyl}-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Catalog ID
STK305642
SMILES FC(c1nn(c(c1)C)Cc1nn2c(n1)c1c(nc2)sc2c1CCC(C2)C(C)(C)C)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 C21H24F2N6S MW 430.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24F2N6S/c1-11-7-14(18(22)23)26-28(11)9-16-25-19-17-13-6-5-12(21(2,3)4)8-15(13)30-20(17)24-10-29(19)27-16/h7,10,12,18H,5-6,8-9H2,1-4H3InChIKey
RHZFMBOOPYTTRG-UHFFFAOYSA-NSynonyms
1005641-90-61005641906
9tertbutyl2((3(difluoromethyl)5methyl1Hpyrazol1yl)methyl)891011tetrahydro(1)benzothieno(32e)(124)triazolo(15c)pyrimidine
CC1=CC(=NN1CC2=NN3C=NC4=C(C3=N2)C5=C(S4)CC(CC5)C(C)(C)C)C(F)F
InChI=1SC21H24F2N6Sc111714(18(22)23)2628(11)916251917136512(21(23)4)815(13)3020(17)241029(19)2716h7101218H5689H214H3
MFCD04046006
ZINC000002787039
ZINC000002787040
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