Vitas-M small molecule compound
ethyl 6-{[4-(2,5-dimethylphenyl)piperazin-1-yl]methyl}-4-(4-ethoxyphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STL027942
SMILES CCOC(=O)C1=C(CN2CCN(CC2)c2cc(C)ccc2C)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 C28H36N4O4 MW 492.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H36N4O4/c1-5-35-22-11-9-21(10-12-22)26-25(27(33)36-6-2)23(29-28(34)30-26)18-31-13-15-32(16-14-31)24-17-19(3)7-8-20(24)4/h7-12,17,26H,5-6,13-16,18H2,1-4H3,(H2,29,30,34)InChIKey
LCEQZIQMVNFHHK-UHFFFAOYSA-NSynonyms
CCOC1=CC=C(C=C1)C2C(=C(NC(=O)N2)CN3CCN(CC3)C4=C(C=CC(=C4)C)C)C(=O)OCC
ethyl6((4(25dimethylphenyl)piperazin1yl)methyl)4(4ethoxyphenyl)2oxo1234tetrahydropyrimidine5carboxylate
ethyl6((4(25dimethylphenyl)piperazin1yl)methyl)4(4ethoxyphenyl)2oxo34dihydro1Hpyrimidine5carboxylate
InChI=1SC28H36N4O4c15352211921(101222)2625(27(33)3662)23(2928(34)3026)1831131532(161431)241719(3)7820(24)4h7121726H56131618H214H3(H2293034)
MFCD18188533
ZINC000067689682
ZINC000067689683
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