Vitas-M small molecule compound
ethyl 6-{[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methyl}-4-(4-methylphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STK986923
SMILES CCOC(=O)C1=C(CN2CCN(CC2)Cc2ccc3c(c2)OCO3)NC(=O)NC1c1ccc(cc1)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 C27H32N4O5 MW 492.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H32N4O5/c1-3-34-26(32)24-21(28-27(33)29-25(24)20-7-4-18(2)5-8-20)16-31-12-10-30(11-13-31)15-19-6-9-22-23(14-19)36-17-35-22/h4-9,14,25H,3,10-13,15-17H2,1-2H3,(H2,28,29,33)InChIKey
RBEAOMUQUAXASP-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(NC(=O)NC1C2=CC=C(C=C2)C)CN3CCN(CC3)CC4=CC5=C(C=C4)OCO5
ethyl6((4(13benzodioxol5ylmethyl)piperazin1yl)methyl)4(4methylphenyl)2oxo1234tetrahydropyrimidine5carboxylate
ethyl6((4(13benzodioxol5ylmethyl)piperazin1yl)methyl)4(4methylphenyl)2oxo34dihydro1Hpyrimidine5carboxylate
InChI=1SC27H32N4O5c133426(32)2421(2827(33)2925(24)207418(2)5820)1631121030(111331)1519692223(1419)36173522h491425H310131517H212H3(H2282933)
MFCD14918269
ZINC000020560281
ZINC000020560283
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