Vitas-M small molecule compound

ethyl 6-[(diethylamino)methyl]-4-[4-methoxy-3-(methoxymethyl)phenyl]-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate

Catalog ID
STK314263
SMILES CCOC(=O)C1=C(CN(CC)CC)NC(=O)NC1c1ccc(c(c1)COC)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 C21H31N3O5 MW 405.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H31N3O5/c1-6-24(7-2)12-16-18(20(25)29-8-3)19(23-21(26)22-16)14-9-10-17(28-5)15(11-14)13-27-4/h9-11,19H,6-8,12-13H2,1-5H3,(H2,22,23,26)
InChIKey
WXWKSULAGSVHDH-UHFFFAOYSA-N
Synonyms
832745-90-1
832745901
CCN(CC)CC1=C(C(NC(=O)N1)C2=CC(=C(C=C2)OC)COC)C(=O)OCC
ethyl6((diethylamino)methyl)4(4methoxy3(methoxymethyl)phenyl)2oxo1234tetrahydropyrimidine5carboxylate
ethyl6(diethylaminomethyl)4(4methoxy3(methoxymethyl)phenyl)2oxo34dihydro1Hpyrimidine5carboxylate
InChI=1SC21H31N3O5c1624(72)121618(20(25)2983)19(2321(26)2216)1491017(285)15(1114)13274h91119H681213H215H3(H2222326)
MFCD05667597
ZINC000013960831
ZINC000013960832

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.