Vitas-M small molecule compound

2-methyl-3-(1-methyl-1H-benzimidazol-2-yl)-7-[(4-nitrobenzyl)oxy]-4H-chromen-4-one

Catalog ID
STK837145
SMILES [O-][N+](=O)c1ccc(cc1)COc1ccc2c(c1)oc(c(c2=O)c1nc2c(n1C)cccc2)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 C25H19N3O5 MW 441.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H19N3O5/c1-15-23(25-26-20-5-3-4-6-21(20)27(25)2)24(29)19-12-11-18(13-22(19)33-15)32-14-16-7-9-17(10-8-16)28(30)31/h3-13H,14H2,1-2H3
InChIKey
YLULKJHNIPRGOO-UHFFFAOYSA-N
Synonyms
6239-78-7
(O)(N+)(=O)c1ccc(cc1)COc1ccc2c(c1)oc(c(c2=O)c1nc2c(n1C)cccc2)C
2methyl3(1methyl1Hbenzimidazol2yl)7((4nitrobenzyl)oxy)4Hchromen4one
2METHYL3(1METHYL1HBENZO(D)IMIDAZOL2YL)7((4NITROBENZYL)OXY)4HCHROMEN4ONE
2METHYL3(1METHYLBENZIMIDAZOL2YL)7((4NITROPHENYL)METHOXY)CHROMEN4ONE
6239787
CC1=C(C(=O)C2=C(O1)C=C(C=C2)OCC3=CC=C(C=C3)(N+)(=O)(O))C4=NC5=CC=CC=C5N4C
InChI=1SC25H19N3O5c11523(252620534621(20)27(25)2)24(29)19121118(1322(19)3315)3214167917(10816)28(30)31h313H14H212H3
MFCD01847695
ZINC000001108008
ZINC01108008
ZINC1108008

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Available files

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