Vitas-M small molecule compound

(5Z)-5-[(3-{4-[(2-fluorobenzyl)oxy]phenyl}-1-phenyl-1H-pyrazol-4-yl)methylidene]-2-(piperidin-1-yl)-1,3-thiazol-4(5H)-one

Catalog ID
STK798511
SMILES O=C1N=C(S/C/1=C\c1cn(nc1c1ccc(cc1)OCc1ccccc1F)c1ccccc1)N1CCCCC1

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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 C31H27FN4O2S MW 538.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H27FN4O2S/c32-27-12-6-5-9-23(27)21-38-26-15-13-22(14-16-26)29-24(20-36(34-29)25-10-3-1-4-11-25)19-28-30(37)33-31(39-28)35-17-7-2-8-18-35/h1,3-6,9-16,19-20H,2,7-8,17-18,21H2/b28-19-
InChIKey
WLIKRNXEIQVZKT-USHMODERSA-N
Synonyms

(5Z)5((3(4((2fluorobenzyl)oxy)phenyl)1phenyl1Hpyrazol4yl)methylidene)2(piperidin1yl)13thiazol4(5H)one
(5Z)5((3(4((2FLUOROPHENYL)METHOXY)PHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)2PIPERIDIN1YL13THIAZOL4ONE
C1CCN(CC1)C2=NC(=O)C(=CC3=CN(N=C3C4=CC=C(C=C4)OCC5=CC=CC=C5F)C6=CC=CC=C6)S2
InChI=1SC31H27FN4O2Sc32271265923(27)213826151322(141626)2924(2036(3429)25103141125)192830(37)3331(3928)35177281835h1369161920H278171821H2b2819
MFCD03417715
O=C1N=C(SC1=Cc1cn(nc1c1ccc(cc1)OCc1ccccc1F)c1ccccc1)N1CCCCC1
ZINC000100838905
ZINC100838905

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Available files

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