Vitas-M small molecule compound
methyl 6-{[4-(ethoxycarbonyl)piperazin-1-yl]methyl}-4-(3-methoxyphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STL107932
SMILES CCOC(=O)N1CCN(CC1)CC1=C(C(=O)OC)C(NC(=O)N1)c1cccc(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 C21H28N4O6 MW 432.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H28N4O6/c1-4-31-21(28)25-10-8-24(9-11-25)13-16-17(19(26)30-3)18(23-20(27)22-16)14-6-5-7-15(12-14)29-2/h5-7,12,18H,4,8-11,13H2,1-3H3,(H2,22,23,27)InChIKey
HQSQIMYTESYVCX-UHFFFAOYSA-NSynonyms
CCOC(=O)N1CCN(CC1)CC2=C(C(NC(=O)N2)C3=CC(=CC=C3)OC)C(=O)OC
InChI=1SC21H28N4O6c143121(28)2510824(91125)131617(19(26)303)18(2320(27)2216)1465715(1214)292h571218H481113H213H3(H2222327)
methyl6((4(ethoxycarbonyl)piperazin1yl)methyl)4(3methoxyphenyl)2oxo1234tetrahydropyrimidine5carboxylate
methyl6((4ethoxycarbonylpiperazin1yl)methyl)4(3methoxyphenyl)2oxo34dihydro1Hpyrimidine5carboxylate
MFCD20741815
ZINC000067287827
ZINC000067287829
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