Vitas-M small molecule compound
ethyl 6-{[4-(5-chloro-2-methylphenyl)piperazin-1-yl]methyl}-4-(3-methoxyphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STL027766
SMILES CCOC(=O)C1=C(CN2CCN(CC2)c2cc(Cl)ccc2C)NC(=O)NC1c1cccc(c1)OC
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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 C26H31ClN4O4 MW 499.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H31ClN4O4/c1-4-35-25(32)23-21(28-26(33)29-24(23)18-6-5-7-20(14-18)34-3)16-30-10-12-31(13-11-30)22-15-19(27)9-8-17(22)2/h5-9,14-15,24H,4,10-13,16H2,1-3H3,(H2,28,29,33)InChIKey
LMGBWJUSIVAVGP-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(NC(=O)NC1C2=CC(=CC=C2)OC)CN3CCN(CC3)C4=C(C=CC(=C4)Cl)C
ethyl6((4(5chloro2methylphenyl)piperazin1yl)methyl)4(3methoxyphenyl)2oxo1234tetrahydropyrimidine5carboxylate
ethyl6((4(5chloro2methylphenyl)piperazin1yl)methyl)4(3methoxyphenyl)2oxo34dihydro1Hpyrimidine5carboxylate
InChI=1SC26H31ClN4O4c143525(32)2321(2826(33)2924(23)1865720(1418)343)1630101231(131130)221519(27)9817(22)2h59141524H4101316H213H3(H2282933)
MFCD18188368
ZINC000067689614
ZINC000067689615
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