Vitas-M small molecule compound

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

Catalog ID
STK796381
SMILES O=C(c1ccc(cc1)[N+](=O)[O-])Nc1ccc2c(c1)nc(n2C)CCN1CCN(CC1)c1ccccn1

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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 C26H27N7O3 MW 485.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27N7O3/c1-30-23-10-7-20(28-26(34)19-5-8-21(9-6-19)33(35)36)18-22(23)29-25(30)11-13-31-14-16-32(17-15-31)24-4-2-3-12-27-24/h2-10,12,18H,11,13-17H2,1H3,(H,28,34)
InChIKey
WEXNTOXJTMWJIY-UHFFFAOYSA-N
Synonyms
901582-52-3
901582523
CN1C2=C(C=C(C=C2)NC(=O)C3=CC=C(C=C3)(N+)(=O)(O))N=C1CCN4CCN(CC4)C5=CC=CC=N5
InChI=1SC26H27N7O3c1302310720(2826(34)195821(9619)33(35)36)1822(23)2925(30)111331141632(171531)24423122724h2101218H111317H21H3(H2834)
MFCD06783220
N(1methyl2(2(4(pyridin2yl)piperazin1yl)ethyl)1Hbenzimidazol5yl)4nitrobenzamide
N(1methyl2(2(4(pyridin2yl)piperazin1yl)ethyl)1Hbenzo(d)imidazol5yl)4nitrobenzamide
N(1METHYL2(2(4PYRIDIN2YLPIPERAZIN1YL)ETHYL)BENZIMIDAZOL5YL)4NITROBENZAMIDE
O=C(c1ccc(cc1)(N+)(=O)(O))Nc1ccc2c(c1)nc(n2C)CCN1CCN(CC1)c1ccccn1
ZINC000009009994
ZINC9009994

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Available files

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