Vitas-M small molecule compound
ethyl 4-[3-(4-butoxy-3-methylphenyl)-1-phenyl-1H-pyrazol-4-yl]-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STK811176
SMILES CCCCOc1ccc(cc1C)c1nn(cc1C1NC(=O)NC(=C1C(=O)OCC)C)c1ccccc1
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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 C28H32N4O4 MW 488.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H32N4O4/c1-5-7-15-36-23-14-13-20(16-18(23)3)25-22(17-32(31-25)21-11-9-8-10-12-21)26-24(27(33)35-6-2)19(4)29-28(34)30-26/h8-14,16-17,26H,5-7,15H2,1-4H3,(H2,29,30,34)InChIKey
KTAUYNNRSHPMAX-UHFFFAOYSA-NSynonyms
956262-82-1956262821
CCCCOC1=C(C=C(C=C1)C2=NN(C=C2C3C(=C(NC(=O)N3)C)C(=O)OCC)C4=CC=CC=C4)C
ethyl4(3(4butoxy3methylphenyl)1phenyl1Hpyrazol4yl)6methyl2oxo1234tetrahydropyrimidine5carboxylate
ETHYL4(3(4BUTOXY3METHYLPHENYL)1PHENYLPYRAZOL4YL)6METHYL2OXO34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
InChI=1SC28H32N4O4c157153623141320(1618(23)3)2522(1732(3125)211198101221)2624(27(33)3562)19(4)2928(34)3026h814161726H5715H214H3(H2293034)
MFCD03294509
ZINC000013582862
ZINC000013582865
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