Vitas-M small molecule compound
ethyl 6-[(3-cyanophenoxy)methyl]-4-(1-ethyl-1H-pyrazol-4-yl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STL398412
SMILES CCOC(=O)C1=C(COc2cccc(c2)C#N)NC(=O)NC1c1cnn(c1)CC
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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 C20H21N5O4 MW 395.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N5O4/c1-3-25-11-14(10-22-25)18-17(19(26)28-4-2)16(23-20(27)24-18)12-29-15-7-5-6-13(8-15)9-21/h5-8,10-11,18H,3-4,12H2,1-2H3,(H2,23,24,27)InChIKey
HLTAEWDZIAJCCZ-UHFFFAOYSA-NSynonyms
1005683-98-61005683986
CCN1C=C(C=N1)C2C(=C(NC(=O)N2)COC3=CC=CC(=C3)C#N)C(=O)OCC
ethyl6((3cyanophenoxy)methyl)4(1ethyl1Hpyrazol4yl)2oxo1234tetrahydropyrimidine5carboxylate
ethyl6((3cyanophenoxy)methyl)4(1ethylpyrazol4yl)2oxo34dihydro1Hpyrimidine5carboxylate
InChI=1SC20H21N5O4c13251114(102225)1817(19(26)2842)16(2320(27)2418)12291575613(815)921h58101118H3412H212H3(H2232427)
MFCD05667284
ZINC000017080793
ZINC000017080794
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