Vitas-M small molecule compound
ethyl 6-{[4-(tert-butoxycarbonyl)piperazin-1-yl]methyl}-4-(2-ethoxyphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STL028035
SMILES CCOC(=O)C1=C(CN2CCN(CC2)C(=O)OC(C)(C)C)NC(=O)NC1c1ccccc1OCC
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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 C25H36N4O6 MW 488.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H36N4O6/c1-6-33-19-11-9-8-10-17(19)21-20(22(30)34-7-2)18(26-23(31)27-21)16-28-12-14-29(15-13-28)24(32)35-25(3,4)5/h8-11,21H,6-7,12-16H2,1-5H3,(H2,26,27,31)InChIKey
WEBSFLMBJOKJSD-UHFFFAOYSA-NSynonyms
CCOC1=CC=CC=C1C2C(=C(NC(=O)N2)CN3CCN(CC3)C(=O)OC(C)(C)C)C(=O)OCC
ethyl4(2ethoxyphenyl)6((4((2methylpropan2yl)oxycarbonyl)piperazin1yl)methyl)2oxo34dihydro1Hpyrimidine5carboxylate
ethyl6((4(tertbutoxycarbonyl)piperazin1yl)methyl)4(2ethoxyphenyl)2oxo1234tetrahydropyrimidine5carboxylate
InChI=1SC25H36N4O6c16331911981017(19)2120(22(30)3472)18(2623(31)2721)1628121429(151328)24(32)3525(34)5h81121H671216H215H3(H2262731)
MFCD18188626
ZINC000067689744
ZINC000067689745
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