Vitas-M small molecule compound
ethyl 6-{[4-(tert-butoxycarbonyl)piperazin-1-yl]methyl}-4-(4-ethylphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STL073313
SMILES CCOC(=O)C1=C(CN2CCN(CC2)C(=O)OC(C)(C)C)NC(=O)NC1c1ccc(cc1)CC
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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 C25H36N4O5 MW 472.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H36N4O5/c1-6-17-8-10-18(11-9-17)21-20(22(30)33-7-2)19(26-23(31)27-21)16-28-12-14-29(15-13-28)24(32)34-25(3,4)5/h8-11,21H,6-7,12-16H2,1-5H3,(H2,26,27,31)InChIKey
ZYUDMRLBGXWSFP-UHFFFAOYSA-NSynonyms
1261021-46-81261021468
CCC1=CC=C(C=C1)C2C(=C(NC(=O)N2)CN3CCN(CC3)C(=O)OC(C)(C)C)C(=O)OCC
ethyl4(4ethylphenyl)6((4((2methylpropan2yl)oxycarbonyl)piperazin1yl)methyl)2oxo34dihydro1Hpyrimidine5carboxylate
ethyl6((4(tertbutoxycarbonyl)piperazin1yl)methyl)4(4ethylphenyl)2oxo1234tetrahydropyrimidine5carboxylate
InChI=1SC25H36N4O5c161781018(11917)2120(22(30)3372)19(2623(31)2721)1628121429(151328)24(32)3425(34)5h81121H671216H215H3(H2262731)
MFCD18194849
ZINC000057478471
ZINC000057478473
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