Vitas-M small molecule compound
ethyl 4-(4-ethoxyphenyl)-6-{[4-(3-methylphenyl)piperazin-1-yl]methyl}-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STL027940
SMILES CCOC(=O)C1=C(CN2CCN(CC2)c2cccc(c2)C)NC(=O)NC1c1ccc(cc1)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 C27H34N4O4 MW 478.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H34N4O4/c1-4-34-22-11-9-20(10-12-22)25-24(26(32)35-5-2)23(28-27(33)29-25)18-30-13-15-31(16-14-30)21-8-6-7-19(3)17-21/h6-12,17,25H,4-5,13-16,18H2,1-3H3,(H2,28,29,33)InChIKey
QEBFYPDONNBESP-UHFFFAOYSA-NSynonyms
CCOC1=CC=C(C=C1)C2C(=C(NC(=O)N2)CN3CCN(CC3)C4=CC=CC(=C4)C)C(=O)OCC
ethyl4(4ethoxyphenyl)6((4(3methylphenyl)piperazin1yl)methyl)2oxo1234tetrahydropyrimidine5carboxylate
ethyl4(4ethoxyphenyl)6((4(3methylphenyl)piperazin1yl)methyl)2oxo34dihydro1Hpyrimidine5carboxylate
InChI=1SC27H34N4O4c14342211920(101222)2524(26(32)3552)23(2827(33)2925)1830131531(161430)2186719(3)1721h6121725H45131618H213H3(H2282933)
MFCD18188531
ZINC000057415525
ZINC000057415527
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