Vitas-M small molecule compound
4-(1-benzofuran-2-ylcarbonyl)-5-(4-ethoxy-3-methoxyphenyl)-3-hydroxy-1-[3-(1H-imidazol-1-yl)propyl]-1,5-dihydro-2H-pyrrol-2-one
Catalog ID
STK704281
SMILES CCOc1ccc(cc1OC)C1N(CCCn2cncc2)C(=O)C(=C1C(=O)c1cc2c(o1)cccc2)O
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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 C28H27N3O6 MW 501.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H27N3O6/c1-3-36-21-10-9-19(16-22(21)35-2)25-24(26(32)23-15-18-7-4-5-8-20(18)37-23)27(33)28(34)31(25)13-6-12-30-14-11-29-17-30/h4-5,7-11,14-17,25,33H,3,6,12-13H2,1-2H3InChIKey
BRHDMLMBUSRNAH-UHFFFAOYSA-NSynonyms
3(1BENZOFURAN2CARBONYL)2(4ETHOXY3METHOXYPHENYL)4HYDROXY1(3IMIDAZOL1YLPROPYL)2HPYRROL5ONE
4(1benzofuran2ylcarbonyl)5(4ethoxy3methoxyphenyl)3hydroxy1(3(1Himidazol1yl)propyl)15dihydro2Hpyrrol2one
CCOC1=C(C=C(C=C1)C2C(=C(C(=O)N2CCCN3C=CN=C3)O)C(=O)C4=CC5=CC=CC=C5O4)OC
InChI=1SC28H27N3O6c13362110919(1622(21)352)2524(26(32)231518745820(18)3723)27(33)28(34)31(25)13612301411291730h4571114172533H361213H212H3
MFCD03509151
ZINC000000702961
ZINC000000702962
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