Vitas-M small molecule compound

(5Z)-2-(4-benzylpiperidin-1-yl)-5-(2,4-diethoxybenzylidene)-1,3-thiazol-4(5H)-one

Catalog ID
STK064436
SMILES CCOc1cc(OCC)ccc1/C=C/1\SC(=NC1=O)N1CCC(CC1)Cc1ccccc1

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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 C26H30N2O3S MW 450.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H30N2O3S/c1-3-30-22-11-10-21(23(18-22)31-4-2)17-24-25(29)27-26(32-24)28-14-12-20(13-15-28)16-19-8-6-5-7-9-19/h5-11,17-18,20H,3-4,12-16H2,1-2H3/b24-17-
InChIKey
OXCTZGDMMKECOK-ULJHMMPZSA-N
Synonyms
827584-50-9
(5Z)2(4BENZYLPIPERIDIN1YL)5((24DIETHOXYPHENYL)METHYLIDENE)13THIAZOL4ONE
(5Z)2(4BENZYLPIPERIDIN1YL)5(24DIETHOXYBENZYLIDENE)13THIAZOL4(5H)ONE
(Z)2(4benzylpiperidin1yl)5(24diethoxybenzylidene)thiazol4(5H)one
827584509
CCOC1=CC(=C(C=C1)C=C2C(=O)N=C(S2)N3CCC(CC3)CC4=CC=CC=C4)OCC
CCOc1cc(OCC)ccc1C=C1SC(=NC1=O)N1CCC(CC1)Cc1ccccc1
InChI=1SC26H30N2O3Sc133022111021(23(1822)3142)172425(29)2726(3224)28141220(131528)16198657919h511171820H341216H212H3b2417
MFCD03695342
STK064436
ZINC000002258125
ZINC02258125
ZINC2258125

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Available files

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