Vitas-M small molecule compound
2-(1,3-benzothiazol-2-yl)-4-{(E)-[(2,2,6,6-tetramethylpiperidin-4-yl)imino]methyl}-5-(trifluoromethyl)-1,2-dihydro-3H-pyrazol-3-one
Catalog ID
STK000348
SMILES O=c1n([nH]c(c1/C=N/C1CC(C)(C)NC(C1)(C)C)C(F)(F)F)c1nc2c(s1)cccc2
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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 C21H24F3N5OS MW 451.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24F3N5OS/c1-19(2)9-12(10-20(3,4)28-19)25-11-13-16(21(22,23)24)27-29(17(13)30)18-26-14-7-5-6-8-15(14)31-18/h5-8,11-12,27-28H,9-10H2,1-4H3/b25-11+InChIKey
DBNIPKKGJWTSPC-OPEKNORGSA-NSynonyms
405269-19-4(E)2(benzo(d)thiazol2yl)4(((2266tetramethylpiperidin4yl)imino)methyl)5(trifluoromethyl)1Hpyrazol3(2H)one
2(13benzothiazol2yl)4((E)((2266tetramethylpiperidin4yl)imino)methyl)5(trifluoromethyl)12dihydro3Hpyrazol3one
405269194
MFCD01810966
O=c1n((nH)c(c1C=NC1CC(C)(C)NC(C1)(C)C)C(F)(F)F)c1nc2c(s1)cccc2
STK000348
ZINC000018068097
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