Vitas-M small molecule compound
3-({4-hydroxy-4-[3-(trifluoromethyl)phenyl]piperidin-1-yl}carbonyl)-1H-isothiochromen-1-one
Catalog ID
STL569459
SMILES O=C(c1cc2ccccc2c(=O)s1)N1CCC(CC1)(O)c1cccc(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 C22H18F3NO3S MW 433.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18F3NO3S/c23-22(24,25)16-6-3-5-15(13-16)21(29)8-10-26(11-9-21)19(27)18-12-14-4-1-2-7-17(14)20(28)30-18/h1-7,12-13,29H,8-11H2InChIKey
DDTSWUMOPIIERL-UHFFFAOYSA-NSynonyms
132351687
3((4hydroxy4(3(trifluoromethyl)phenyl)piperidin1yl)carbonyl)1Hisothiochromen1one
3(4hydroxy4(3(trifluoromethyl)phenyl)piperidine1carbonyl)1Hisothiochromen1one
3(4hydroxy4(3(trifluoromethyl)phenyl)piperidine1carbonyl)isothiochromen1one
InChI=1SC22H18F3NO3Sc2322(2425)1663515(1316)21(29)81026(11921)19(27)181214412717(14)20(28)3018h17121329H811H2
MFCD32654416
ZINC000828147261
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