Vitas-M small molecule compound

N-{2-[2-(4-ethylpiperazin-1-yl)ethyl]-1-methyl-1H-benzimidazol-5-yl}-4-nitrobenzamide

Catalog ID
STK573787
SMILES CCN1CCN(CC1)CCc1nc2c(n1C)ccc(c2)NC(=O)c1ccc(cc1)[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 C23H28N6O3 MW 436.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H28N6O3/c1-3-27-12-14-28(15-13-27)11-10-22-25-20-16-18(6-9-21(20)26(22)2)24-23(30)17-4-7-19(8-5-17)29(31)32/h4-9,16H,3,10-15H2,1-2H3,(H,24,30)
InChIKey
MMTGWKLLQKWUCM-UHFFFAOYSA-N
Synonyms
879477-10-8
879477108
CCN1CCN(CC1)CCc1nc2c(n1C)ccc(c2)NC(=O)c1ccc(cc1)(N+)(=O)(O)
CCN1CCN(CC1)CCC2=NC3=C(N2C)C=CC(=C3)NC(=O)C4=CC=C(C=C4)(N+)(=O)(O)
InChI=1SC23H28N6O3c1327121428(151327)11102225201618(6921(20)26(22)2)2423(30)174719(8517)29(31)32h4916H31015H212H3(H2430)
MFCD06612617
N(2(2(4ethylpiperazin1yl)ethyl)1methyl1Hbenzimidazol5yl)4nitrobenzamide
N(2(2(4ethylpiperazin1yl)ethyl)1methyl1Hbenzo(d)imidazol5yl)4nitrobenzamide
N(2(2(4ETHYLPIPERAZIN1YL)ETHYL)1METHYLBENZIMIDAZOL5YL)4NITROBENZAMIDE
ZINC000009016006
ZINC9016006

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Available files

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