Vitas-M small molecule compound

1-heptyl-3-[2-(4-nitrophenyl)-2-oxoethyl]-1,3-dihydro-2H-benzimidazol-2-iminium

Catalog ID
STL589892
SMILES CCCCCCCn1c(=[NH2+])n(c2c1cccc2)CC(=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 C22H27N4O3 MW 395.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26N4O3/c1-2-3-4-5-8-15-24-19-9-6-7-10-20(19)25(22(24)23)16-21(27)17-11-13-18(14-12-17)26(28)29/h6-7,9-14,23H,2-5,8,15-16H2,1H3/p+1
InChIKey
RZQAEMUUEVTBEY-UHFFFAOYSA-O
Synonyms

1heptyl3(2(4nitrophenyl)2oxoethyl)13dihydro2Hbenzimidazol2iminium
InChI=1SC22H26N4O3c1234581524199671020(19)25(22(24)23)1621(27)17111318(141217)26(28)29h6791423H2581516H21H3p+1

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Available files

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