Vitas-M small molecule compound
2-(1,3-benzothiazol-2-yl)-4-{(E)-[(4-methoxybenzyl)imino]methyl}-5-(trifluoromethyl)-1,2-dihydro-3H-pyrazol-3-one
Catalog ID
STL446464
SMILES COc1ccc(cc1)C/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 C20H15F3N4O2S MW 432.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15F3N4O2S/c1-29-13-8-6-12(7-9-13)10-24-11-14-17(20(21,22)23)26-27(18(14)28)19-25-15-4-2-3-5-16(15)30-19/h2-9,11,26H,10H2,1H3/b24-11+InChIKey
AJUKWGLDKAGJGJ-BHGWPJFGSA-NSynonyms
337502-74-62(13benzothiazol2yl)4((E)((4methoxybenzyl)imino)methyl)5(trifluoromethyl)12dihydro3Hpyrazol3one
337502746
COc1ccc(cc1)CN=Cc1c(=O)n((nH)c1C(F)(F)F)c1nc2c(s1)cccc2
MFCD06241647
ZINC000103540262
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