Vitas-M small molecule compound

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

Catalog ID
STK706849
SMILES O=C1N=C(S/C/1=C\c1cn(nc1c1cccc(c1)OCc1ccccc1)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 C31H28N4O2S MW 520.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H28N4O2S/c36-30-28(38-31(32-30)34-17-8-3-9-18-34)20-25-21-35(26-14-6-2-7-15-26)33-29(25)24-13-10-16-27(19-24)37-22-23-11-4-1-5-12-23/h1-2,4-7,10-16,19-21H,3,8-9,17-18,22H2/b28-20-
InChIKey
KBPHCWHNFVWUFS-RRAHZORUSA-N
Synonyms
1009436-61-6
(5Z)5((1PHENYL3(3PHENYLMETHOXYPHENYL)PYRAZOL4YL)METHYLIDENE)2PIPERIDIN1YL13THIAZOL4ONE
(5Z)5((3(3(benzyloxy)phenyl)1phenyl1Hpyrazol4yl)methylidene)2(piperidin1yl)13thiazol4(5H)one
(Z)5((3(3(benzyloxy)phenyl)1phenyl1Hpyrazol4yl)methylene)2(piperidin1yl)thiazol4(5H)one
1009436616
C1CCN(CC1)C2=NC(=O)C(=CC3=CN(N=C3C4=CC(=CC=C4)OCC5=CC=CC=C5)C6=CC=CC=C6)S2
InChI=1SC31H28N4O2Sc363028(3831(3230)34178391834)20252135(26146271526)3329(25)2413101627(1924)372223114151223h124710161921H389171822H2b2820
MFCD04009191
O=C1N=C(SC1=Cc1cn(nc1c1cccc(c1)OCc1ccccc1)c1ccccc1)N1CCCCC1
ZINC000013752080
ZINC13752080

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Available files

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