Vitas-M small molecule compound
ethyl 6-{[4-(ethoxycarbonyl)piperidin-1-yl]methyl}-2-oxo-4-(thiophen-2-yl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STL107954
SMILES CCOC(=O)C1CCN(CC1)CC1=C(C(=O)OCC)C(NC(=O)N1)c1cccs1
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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 C20H27N3O5S MW 421.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H27N3O5S/c1-3-27-18(24)13-7-9-23(10-8-13)12-14-16(19(25)28-4-2)17(22-20(26)21-14)15-6-5-11-29-15/h5-6,11,13,17H,3-4,7-10,12H2,1-2H3,(H2,21,22,26)InChIKey
MHHCWKRJCZNUHM-UHFFFAOYSA-NSynonyms
CCOC(=O)C1CCN(CC1)CC2=C(C(NC(=O)N2)C3=CC=CS3)C(=O)OCC
ethyl6((4(ethoxycarbonyl)piperidin1yl)methyl)2oxo4(thiophen2yl)1234tetrahydropyrimidine5carboxylate
ethyl6((4ethoxycarbonylpiperidin1yl)methyl)2oxo4thiophen2yl34dihydro1Hpyrimidine5carboxylate
InChI=1SC20H27N3O5Sc132718(24)137923(10813)121416(19(25)2842)17(2220(26)2114)1565112915h56111317H3471012H212H3(H2212226)
MFCD14914984
ZINC000020559019
ZINC000020559021
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