Vitas-M small molecule compound
ethyl 1-[(5E)-5-(2-butoxybenzylidene)-4-oxo-4,5-dihydro-1,3-thiazol-2-yl]piperidine-4-carboxylate
Catalog ID
STK812136
SMILES CCCCOc1ccccc1/C=C\1/SC(=NC1=O)N1CCC(CC1)C(=O)OCC
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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 C22H28N2O4S MW 416.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H28N2O4S/c1-3-5-14-28-18-9-7-6-8-17(18)15-19-20(25)23-22(29-19)24-12-10-16(11-13-24)21(26)27-4-2/h6-9,15-16H,3-5,10-14H2,1-2H3/b19-15+InChIKey
YTCXREFUOFLIQL-XDJHFCHBSA-NSynonyms
CCCCOC1=CC=CC=C1C=C2C(=O)N=C(S2)N3CCC(CC3)C(=O)OCC
CCCCOc1ccccc1C=C1SC(=NC1=O)N1CCC(CC1)C(=O)OCC
ETHYL1((5E)5((2BUTOXYPHENYL)METHYLIDENE)4OXO13THIAZOL2YL)PIPERIDINE4CARBOXYLATE
ethyl1((5E)5(2butoxybenzylidene)4oxo45dihydro13thiazol2yl)piperidine4carboxylate
InChI=1SC22H28N2O4Sc135142818976817(18)151920(25)2322(2919)24121016(111324)21(26)2742h691516H351014H212H3b1915+
MFCD03712849
ZINC000002811783
ZINC02811783
ZINC2811783
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