Vitas-M small molecule compound
ethyl 4-(4-ethoxyphenyl)-6-{[4-(4-fluorophenyl)piperazin-1-yl]methyl}-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STL027947
SMILES CCOC(=O)C1=C(CN2CCN(CC2)c2ccc(cc2)F)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 C26H31FN4O4 MW 482.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H31FN4O4/c1-3-34-21-11-5-18(6-12-21)24-23(25(32)35-4-2)22(28-26(33)29-24)17-30-13-15-31(16-14-30)20-9-7-19(27)8-10-20/h5-12,24H,3-4,13-17H2,1-2H3,(H2,28,29,33)InChIKey
HQMWOQPAHCRQOB-UHFFFAOYSA-NSynonyms
1252916-02-11252916021
CCOC1=CC=C(C=C1)C2C(=C(NC(=O)N2)CN3CCN(CC3)C4=CC=C(C=C4)F)C(=O)OCC
ethyl4(4ethoxyphenyl)6((4(4fluorophenyl)piperazin1yl)methyl)2oxo1234tetrahydropyrimidine5carboxylate
ethyl4(4ethoxyphenyl)6((4(4fluorophenyl)piperazin1yl)methyl)2oxo34dihydro1Hpyrimidine5carboxylate
InChI=1SC26H31FN4O4c13342111518(61221)2423(25(32)3542)22(2826(33)2924)1730131531(161430)209719(27)81020h51224H341317H212H3(H2282933)
MFCD18188538
ZINC000067689692
ZINC000067689693
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