Vitas-M small molecule compound
3-(heptafluoropropyl)-8,9-dimethoxy-5,5-dimethyl-2,3,5,6-tetrahydro[1,2,4]triazolo[3,4-a]isoquinolin-3-ol
Catalog ID
STK759591
SMILES COc1cc2c(cc1OC)CC(N1C2=NNC1(O)C(C(C(F)(F)F)(F)F)(F)F)(C)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 C17H18F7N3O3 MW 445.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18F7N3O3/c1-13(2)7-8-5-10(29-3)11(30-4)6-9(8)12-25-26-17(28,27(12)13)15(20,21)14(18,19)16(22,23)24/h5-6,26,28H,7H2,1-4H3InChIKey
KKNLJPNGKFIUCA-UHFFFAOYSA-NSynonyms
3(1122333heptafluoropropyl)89dimethoxy55dimethyl26dihydro(124)triazolo(34a)isoquinolin3ol
3(heptafluoropropyl)89dimethoxy55dimethyl2356tetrahydro(124)triazolo(34a)isoquinolin3ol
CC1(CC2=CC(=C(C=C2C3=NNC(N31)(C(C(C(F)(F)F)(F)F)(F)F)O)OC)OC)C
InChI=1SC17H18F7N3O3c113(2)78510(293)11(304)69(8)12252617(2827(12)13)15(2021)14(1819)16(2223)24h562628H7H214H3
MFCD01461863
ZINC000003668384
ZINC000003668385
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Check stock on Vitas-MAvailable files
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