Vitas-M small molecule compound
3-(1H-benzimidazol-2-yl)-6-ethyl-8-[(2-methylpiperidinium-1-yl)methyl]-4-oxo-4H-chromen-7-olate
Catalog ID
STK635077
SMILES CCc1cc2c(c(c1[O-])C[NH+]1CCCCC1C)occ(c2=O)c1nc2c([nH]1)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 C25H27N3O3 MW 417.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27N3O3/c1-3-16-12-17-23(30)19(25-26-20-9-4-5-10-21(20)27-25)14-31-24(17)18(22(16)29)13-28-11-7-6-8-15(28)2/h4-5,9-10,12,14-15,29H,3,6-8,11,13H2,1-2H3,(H,26,27)InChIKey
HSECWTLJMNNWOK-UHFFFAOYSA-NSynonyms
637747-35-43(1HBENZIMIDAZOL2YL)6ETHYL7HYDROXY8((2METHYLPIPERIDIN1YL)METHYL)CHROMEN4ONE
3(1Hbenzimidazol2yl)6ethyl8((2methylpiperidinium1yl)methyl)4oxo4Hchromen7olate
3(1HBENZO(D)IMIDAZOL2YL)6ETHYL7HYDROXY8((2METHYLPIPERIDIN1YL)METHYL)4HCHROMEN4ONE
3(1HBENZOIMIDAZOL2YL)6ETHYL7HYDROXY8(2METHYLPIPERIDIN1YLMETHYL)CHROMEN4ONE
3BENZIMIDAZOL2YL6ETHYL7HYDROXY8((2METHYLPIPERIDYL)METHYL)CHROMEN4ONE
CCc1cc2c(c(c1(O))C(NH+)1CCCCC1C)occ(c2=O)c1nc2c((nH)1)cccc2
MFCD03669478
ZINC000004247253
ZINC000004247255
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