Vitas-M small molecule compound
5-[4-(benzyloxy)benzyl]-1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-olate
Catalog ID
STL056360
SMILES [O-]c1c(Cc2ccc(cc2)OCc2ccccc2)c(=O)n(c(=O)n1C)C
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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 C20H19N2O4 MW 351.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N2O4/c1-21-18(23)17(19(24)22(2)20(21)25)12-14-8-10-16(11-9-14)26-13-15-6-4-3-5-7-15/h3-11,23H,12-13H2,1-2H3/p-1InChIKey
IEHCDIOCMFVENT-UHFFFAOYSA-MSynonyms
(O)c1c(Cc2ccc(cc2)OCc2ccccc2)c(=O)n(c(=O)n1C)C
(O)c1c(Cc2ccc(cc2)OCc2ccccc2)c(=O)n(c(=O)n1C)C(NH4+)
13DIMETHYL26DIOXO5((4PHENYLMETHOXYPHENYL)METHYL)PYRIMIDIN4OLATE
5(4(benzyloxy)benzyl)13dimethyl26dioxo1236tetrahydropyrimidin4olate
ammonium5(4(benzyloxy)benzyl)13dimethyl26dioxo1236tetrahydropyrimidin4olate
CN1C(=C(C(=O)N(C1=O)C)CC2=CC=C(C=C2)OCC3=CC=CC=C3)(O)
InChI=1SC20H20N2O4c12118(23)17(19(24)22(2)20(21)25)121481016(11914)2613156435715h31123H1213H212H3p1
ZINC000001272972
ZINC01272972
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