Vitas-M small molecule compound

2-(4-methoxyphenoxy)-1-{4-[(1-methyl-5-nitro-1H-benzimidazol-2-yl)methyl]piperazin-1-yl}ethanone

Catalog ID
STK601020
SMILES COc1ccc(cc1)OCC(=O)N1CCN(CC1)Cc1nc2c(n1C)ccc(c2)[N+](=O)[O-]

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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 C22H25N5O5 MW 439.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25N5O5/c1-24-20-8-3-16(27(29)30)13-19(20)23-21(24)14-25-9-11-26(12-10-25)22(28)15-32-18-6-4-17(31-2)5-7-18/h3-8,13H,9-12,14-15H2,1-2H3
InChIKey
ZFXPTVMUALDCEN-UHFFFAOYSA-N
Synonyms
895841-47-1
2(4methoxyphenoxy)1(4((1methyl5nitro1Hbenzimidazol2yl)methyl)piperazin1yl)ethanone
2(4methoxyphenoxy)1(4((1methyl5nitro1Hbenzo(d)imidazol2yl)methyl)piperazin1yl)ethanone
2(4METHOXYPHENOXY)1(4((1METHYL5NITROBENZIMIDAZOL2YL)METHYL)PIPERAZIN1YL)ETHANONE
2(4METHOXYPHENOXY)1(4(1METHYL5NITRO1HBENZOIMIDAZOL2YLMETHYL)PIPERAZIN1YL)ETHANONE
895841471
CN1C2=C(C=C(C=C2)(N+)(=O)(O))N=C1CN3CCN(CC3)C(=O)COC4=CC=C(C=C4)OC
COc1ccc(cc1)OCC(=O)N1CCN(CC1)Cc1nc2c(n1C)ccc(c2)(N+)(=O)(O)
InChI=1SC22H25N5O5c124208316(27(29)30)1319(20)2321(24)142591126(121025)22(28)1532186417(312)5718h3813H9121415H212H3
MFCD06597434
ZINC000020517660
ZINC20517660

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Available files

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