Vitas-M small molecule compound
methyl 4-(3-chlorophenyl)-6-{[4-(ethoxycarbonyl)piperidin-1-yl]methyl}-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STL107496
SMILES CCOC(=O)C1CCN(CC1)CC1=C(C(=O)OC)C(NC(=O)N1)c1cccc(c1)Cl
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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 C21H26ClN3O5 MW 435.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H26ClN3O5/c1-3-30-19(26)13-7-9-25(10-8-13)12-16-17(20(27)29-2)18(24-21(28)23-16)14-5-4-6-15(22)11-14/h4-6,11,13,18H,3,7-10,12H2,1-2H3,(H2,23,24,28)InChIKey
VUXWSNYPOWTUBR-UHFFFAOYSA-NSynonyms
CCOC(=O)C1CCN(CC1)CC2=C(C(NC(=O)N2)C3=CC(=CC=C3)Cl)C(=O)OC
InChI=1SC21H26ClN3O5c133019(26)137925(10813)121617(20(27)292)18(2421(28)2316)1454615(22)1114h46111318H371012H212H3(H2232428)
methyl4(3chlorophenyl)6((4(ethoxycarbonyl)piperidin1yl)methyl)2oxo1234tetrahydropyrimidine5carboxylate
methyl4(3chlorophenyl)6((4ethoxycarbonylpiperidin1yl)methyl)2oxo34dihydro1Hpyrimidine5carboxylate
MFCD20741444
ZINC000067285557
ZINC000067285559
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