Vitas-M small molecule compound
2-(1,3-benzothiazol-2-yl)-4-[(1E)-N-(4-methoxyphenyl)ethanimidoyl]-5-(trifluoromethyl)-1,2-dihydro-3H-pyrazol-3-one
Catalog ID
STK868288
SMILES COc1ccc(cc1)/N=C(/c1c(=O)n([nH]c1C(F)(F)F)c1nc2c(s1)cccc2)\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 C20H15F3N4O2S MW 432.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15F3N4O2S/c1-11(24-12-7-9-13(29-2)10-8-12)16-17(20(21,22)23)26-27(18(16)28)19-25-14-5-3-4-6-15(14)30-19/h3-10,26H,1-2H3/b24-11+InChIKey
DCWDSMFUKRCKPN-BHGWPJFGSA-NSynonyms
371933-13-0(E)2(benzo(d)thiazol2yl)4(1((4methoxyphenyl)imino)ethyl)5(trifluoromethyl)1Hpyrazol3(2H)one
2(13benzothiazol2yl)4((1E)N(4methoxyphenyl)ethanimidoyl)5(trifluoromethyl)12dihydro3Hpyrazol3one
371933130
COc1ccc(cc1)N=C(c1c(=O)n((nH)c1C(F)(F)F)c1nc2c(s1)cccc2)C
MFCD01811035
ZINC000009034214
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