Vitas-M small molecule compound
(2Z)-4-methyl-7-[(2-methylpiperidinium-1-yl)methyl]-3-oxo-2-(pyridin-4-ylmethylidene)-2,3-dihydro-1-benzofuran-6-olate
Catalog ID
STK853626
SMILES Cc1cc([O-])c(c2c1C(=O)/C(=C/c1ccncc1)/O2)C[NH+]1CCCCC1C
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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 C22H24N2O3 MW 364.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24N2O3/c1-14-11-18(25)17(13-24-10-4-3-5-15(24)2)22-20(14)21(26)19(27-22)12-16-6-8-23-9-7-16/h6-9,11-12,15,25H,3-5,10,13H2,1-2H3/b19-12-InChIKey
WABAKMRZAIJNGU-UNOMPAQXSA-NSynonyms
903192-07-4(2Z)4methyl7((2methylpiperidin1ium1yl)methyl)3oxo2(pyridin4ylmethylidene)1benzofuran6olate
(2Z)4methyl7((2methylpiperidinium1yl)methyl)3oxo2(pyridin4ylmethylidene)23dihydro1benzofuran6olate
903192074
Cc1cc((O))c(c2c1C(=O)C(=Cc1ccncc1)O2)C(NH+)1CCCCC1C
CC1CCCC(NH+)1CC2=C(C=C(C3=C2OC(=CC4=CC=NC=C4)C3=O)C)(O)
InChI=1SC22H24N2O3c1141118(25)17(13241043515(24)2)2220(14)21(26)19(2722)121668239716h6911121525H351013H212H3b1912
MFCD08288100
ZINC000020573683
ZINC000020573684
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