Vitas-M small molecule compound
2-(1,3-benzothiazol-2-yl)-4-{(E)-[(3-methoxypropyl)imino]methyl}-5-(trifluoromethyl)-1,2-dihydro-3H-pyrazol-3-one
Catalog ID
STK868286
SMILES COCCC/N=C/c1c(=O)n([nH]c1C(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 C16H15F3N4O2S MW 384.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15F3N4O2S/c1-25-8-4-7-20-9-10-13(16(17,18)19)22-23(14(10)24)15-21-11-5-2-3-6-12(11)26-15/h2-3,5-6,9,22H,4,7-8H2,1H3/b20-9+InChIKey
WAQALCKLIWPGQB-AWQFTUOYSA-NSynonyms
337341-10-3(E)2(benzo(d)thiazol2yl)4(((3methoxypropyl)imino)methyl)5(trifluoromethyl)1Hpyrazol3(2H)one
2(13benzothiazol2yl)4((E)((3methoxypropyl)imino)methyl)5(trifluoromethyl)12dihydro3Hpyrazol3one
337341103
COCCCN=Cc1c(=O)n((nH)c1C(F)(F)F)c1nc2c(s1)cccc2
MFCD01811030
ZINC000002268399
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