Vitas-M small molecule compound
(2Z)-6-hydroxy-2-(4-methoxybenzylidene)-7-methyl-5-[(4-methylpiperazin-1-yl)methyl]-1-benzofuran-3(2H)-one
Catalog ID
STK925378
SMILES COc1ccc(cc1)/C=C/1\Oc2c(C1=O)cc(c(c2C)O)CN1CCN(CC1)C
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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 C23H26N2O4 MW 394.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H26N2O4/c1-15-21(26)17(14-25-10-8-24(2)9-11-25)13-19-22(27)20(29-23(15)19)12-16-4-6-18(28-3)7-5-16/h4-7,12-13,26H,8-11,14H2,1-3H3/b20-12-InChIKey
SRLSJBMNFKOJHL-NDENLUEZSA-NSynonyms
929428-91-1(2Z)2((4methoxyphenyl)methylidene)7methyl5((4methylpiperazin1ium1yl)methyl)3oxo1benzofuran6olate
(2Z)6hydroxy2(4methoxybenzylidene)7methyl5((4methylpiperazin1yl)methyl)1benzofuran3(2H)one
6HYDROXY2((4METHOXYPHENYL)METHYLENE)7METHYL5((4METHYLPIPERAZINYL)METHYL)BENZO(B)FURAN3ONE
929428911
CC1=C2C(=CC(=C1(O))C(NH+)3CCN(CC3)C)C(=O)C(=CC4=CC=C(C=C4)OC)O2
COc1ccc(cc1)C=C1Oc2c(C1=O)cc(c(c2C)O)CN1CCN(CC1)C
InChI=1SC23H26N2O4c11521(26)17(142510824(2)91125)131922(27)20(2923(15)19)12164618(283)7516h47121326H81114H213H3b2012
MFCD10041324
ZINC000022854528
ZINC22854528
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