Vitas-M small molecule compound

3-{[4-(4-methoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}-1-(4-methylpiperazin-1-yl)propan-1-one

Catalog ID
STK339099
SMILES COc1ccc(cc1)c1nc(SCCC(=O)N2CCN(CC2)C)nc(c1)C(F)(F)F

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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 C20H23F3N4O2S MW 440.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23F3N4O2S/c1-26-8-10-27(11-9-26)18(28)7-12-30-19-24-16(13-17(25-19)20(21,22)23)14-3-5-15(29-2)6-4-14/h3-6,13H,7-12H2,1-2H3
InChIKey
QZBOXGWSGZLWDF-UHFFFAOYSA-N
Synonyms
510711-30-5
3((4(4methoxyphenyl)6(trifluoromethyl)pyrimidin2yl)sulfanyl)1(4methylpiperazin1yl)propan1one
3(4(4methoxyphenyl)6(trifluoromethyl)pyrimidin2yl)sulfanyl1(4methylpiperazin1yl)propan1one
3(4(4METHOXYPHENYL)6(TRIFLUOROMETHYL)PYRIMIDIN2YLTHIO)1(4METHYLPIPERAZINYL)PROPAN1ONE
3(4(4METHOXYPHENYL)6TRIFLUOROMETHYLPYRIMIDIN2YLSULFANYL)1(4METHYLPIPERAZIN1YL)PROPAN1ONE
4(4METHOXYPHENYL)2((3(4METHYL1PIPERAZINYL)3OXOPROPYL)SULFANYL)6(TRIFLUOROMETHYL)PYRIMIDINE
510711305
CN1CCN(CC1)C(=O)CCSC2=NC(=CC(=N2)C(F)(F)F)C3=CC=C(C=C3)OC
InChI=1SC20H23F3N4O2Sc12681027(11926)18(28)71230192416(1317(2519)20(2122)23)143515(292)6414h3613H712H212H3
MFCD03043216
ZINC000019589713
ZINC19589713

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Available files

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