Vitas-M small molecule compound

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

Catalog ID
STK796975
SMILES C=CCOc1ccc(cc1)c1nn(cc1/C=C/1\SC(=NC1=O)N1CCCCC1)c1ccccc1

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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 C27H26N4O2S MW 470.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26N4O2S/c1-2-17-33-23-13-11-20(12-14-23)25-21(19-31(29-25)22-9-5-3-6-10-22)18-24-26(32)28-27(34-24)30-15-7-4-8-16-30/h2-3,5-6,9-14,18-19H,1,4,7-8,15-17H2/b24-18-
InChIKey
QXHHUHVAYBGUIH-MOHJPFBDSA-N
Synonyms

(5Z)5((1phenyl3(4(prop2en1yloxy)phenyl)1Hpyrazol4yl)methylidene)2(piperidin1yl)13thiazol4(5H)one
(5Z)5((1PHENYL3(4(PROP2EN1YLOXY)PHENYL)1HPYRAZOL4YL)METHYLIDENE)2(PIPERIDIN1YL)45DIHYDRO13THIAZOL4ONE
(5Z)5((1PHENYL3(4PROP2ENOXYPHENYL)PYRAZOL4YL)METHYLIDENE)2PIPERIDIN1YL13THIAZOL4ONE
(E)5((3(4(allyloxy)phenyl)1phenyl1Hpyrazol4yl)methylene)2(piperidin1yl)thiazol4(5H)one
C=CCOC1=CC=C(C=C1)C2=NN(C=C2C=C3C(=O)N=C(S3)N4CCCCC4)C5=CC=CC=C5
C=CCOc1ccc(cc1)c1nn(cc1C=C1SC(=NC1=O)N1CCCCC1)c1ccccc1
InChI=1SC27H26N4O2Sc12173323131120(121423)2521(1931(2925)2295361022)182426(32)2827(3424)30157481630h23569141819H14781517H2b2418
MFCD03225794
ZINC000019800568
ZINC19800568

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.