Vitas-M small molecule compound

(4Z)-1-(3,4-dimethylphenyl)-4-{4-[2-oxo-2-(piperidin-1-yl)ethoxy]benzylidene}pyrazolidine-3,5-dione

Catalog ID
STL354546
SMILES O=C(N1CCCCC1)COc1ccc(cc1)/C=C\1/C(=O)NN(C1=O)c1ccc(c(c1)C)C

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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 C25H27N3O4 MW 433.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27N3O4/c1-17-6-9-20(14-18(17)2)28-25(31)22(24(30)26-28)15-19-7-10-21(11-8-19)32-16-23(29)27-12-4-3-5-13-27/h6-11,14-15H,3-5,12-13,16H2,1-2H3,(H,26,30)/b22-15-
InChIKey
RKQNIUSOBPUMBJ-JCMHNJIXSA-N
Synonyms

(4Z)1(34DIMETHYLPHENYL)4((4(2OXO2PIPERIDIN1YLETHOXY)PHENYL)METHYLIDENE)PYRAZOLIDINE35DIONE
(4Z)1(34dimethylphenyl)4(4(2oxo2(piperidin1yl)ethoxy)benzylidene)pyrazolidine35dione
(Z)1(34dimethylphenyl)4(4(2oxo2(piperidin1yl)ethoxy)benzylidene)pyrazolidine35dione
CC1=C(C=C(C=C1)N2C(=O)C(=CC3=CC=C(C=C3)OCC(=O)N4CCCCC4)C(=O)N2)C
InChI=1SC25H27N3O4c1176920(1418(17)2)2825(31)22(24(30)2628)151971021(11819)321623(29)27124351327h6111415H35121316H212H3(H2630)b2215
MFCD02326468
O=C(N1CCCCC1)COc1ccc(cc1)C=C1C(=O)NN(C1=O)c1ccc(c(c1)C)C
ZINC000009354880
ZINC09354880
ZINC9354880

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Available files

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