Vitas-M small molecule compound
1-[3-(1-benzofuran-2-yl)-5-(3,4,5-trimethoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]ethanone
Catalog ID
STL433931
SMILES COc1cc(cc(c1OC)OC)C1CC(=NN1C(=O)C)c1cc2c(o1)cccc2
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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 C22H22N2O5 MW 394.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N2O5/c1-13(25)24-17(15-10-20(26-2)22(28-4)21(11-15)27-3)12-16(23-24)19-9-14-7-5-6-8-18(14)29-19/h5-11,17H,12H2,1-4H3InChIKey
BOCLCZNGZIBHIN-UHFFFAOYSA-NSynonyms
1(3(1benzofuran2yl)5(345trimethoxyphenyl)45dihydro1Hpyrazol1yl)ethanone
1(5(1benzofuran2yl)3(345trimethoxyphenyl)34dihydropyrazol2yl)ethanone
CC(=O)N1C(CC(=N1)C2=CC3=CC=CC=C3O2)C4=CC(=C(C(=C4)OC)OC)OC
InChI=1SC22H22N2O5c113(25)2417(151020(262)22(284)21(1115)273)1216(2324)19914756818(14)2919h51117H12H214H3
MFCD26098188
ZINC000078549329
ZINC000078549332
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