Vitas-M small molecule compound

N-(1H-benzimidazol-2-yl)-2-{[4-(4-methoxyphenyl)-8-methyl-2-oxo-2H-chromen-7-yl]oxy}acetamide

Catalog ID
STK607138
SMILES COc1ccc(cc1)c1cc(=O)oc2c1ccc(c2C)OCC(=O)Nc1nc2c([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 C26H21N3O5 MW 455.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H21N3O5/c1-15-22(33-14-23(30)29-26-27-20-5-3-4-6-21(20)28-26)12-11-18-19(13-24(31)34-25(15)18)16-7-9-17(32-2)10-8-16/h3-13H,14H2,1-2H3,(H2,27,28,29,30)
InChIKey
MYPNLTGIFPKMNI-UHFFFAOYSA-N
Synonyms

CC1=C(C=CC2=C1OC(=O)C=C2C3=CC=C(C=C3)OC)OCC(=O)NC4=NC5=CC=CC=C5N4
COc1ccc(cc1)c1cc(=O)oc2c1ccc(c2C)OCC(=O)Nc1nc2c((nH)1)cccc2
InChI=1SC26H21N3O5c11522(331423(30)29262720534621(20)2826)12111819(1324(31)3425(15)18)167917(322)10816h313H14H212H3(H227282930)
MFCD08288372
N(1Hbenzimidazol2yl)2((4(4methoxyphenyl)8methyl2oxo2Hchromen7yl)oxy)acetamide
N(1Hbenzimidazol2yl)2(4(4methoxyphenyl)8methyl2oxochromen7yl)oxyacetamide
N(1Hbenzo(d)imidazol2yl)2((4(4methoxyphenyl)8methyl2oxo2Hchromen7yl)oxy)acetamide
ZINC000009409943
ZINC09409943
ZINC9409943

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.