Molecule record

1-(2-ethoxyethyl)-2-(4-methyl-1,4-diazepan-1-yl)benzimidazole

C17H26N4O

302.42 g/mol

Loading structure

Molecular properties

Formula
C17H26N4O
Molar mass
302.42 g·mol−1
Exact mass
302.2107 Da
7
PubChem CID
3219

Functional groups

Alkane / alkyl carbon
Aromatic ring
Ether
Tertiary amine

Physical properties

No source-backed physical properties are curated for this molecule yet.

Common names and synonyms

  • 1-(2-Ethoxy-ethyl)-2-(4-methyl-[1,4]diazepan-1-yl)-1H-benzoimidazole
  • 1-(2-Ethoxyethyl)-2-(hexahydro-4-methyl-1H-1,4-diazepin-1-yl)benzimidazole
  • 1-(2-ethoxyethyl)-2-(4-methyl-1,4-diazepan-1-yl)-1H-1,3-benzodiazole
  • 1-(2-ethoxyethyl)-2-(4-methyl-1,4-diazepan-1-yl)-1h-benzo[d]imidazole
  • 1-[2-(ethoxy)ethyl]-2-(4-methyl-1-homopiperazinyl)benzimidazole
  • 1H-Benzimidazole, 1-(2-ethoxyethyl)-2-(hexahydro-4-methyl-1H-1,4-diazepin-1-yl)-
  • 87233-61-2
  • 9J1H7Y9OJV
Show all 24 synonyms
  • AKOS037515523
  • C17H26N4O
  • CHEBI:4779
  • CHEMBL594
  • DTXCID8028218
  • DTXSID7048243
  • Emedastina
  • Emedastina [INN-Spanish]
  • Emedastine [INN]
  • Emedastinum
  • Emedastinum [INN-Latin]
  • KG 2413
  • MFCD00865647
  • RefChem:590745
  • S01GX06
  • emedastine

Structure identifiers

Canonical SMILES
CCOCCn1c(N2CCCN(C)CC2)nc2ccccc21
Isomeric SMILES
CCOCCN1C2=CC=CC=C2N=C1N3CCCN(CC3)C
InChI
InChI=1S/C17H26N4O/c1-3-22-14-13-21-16-8-5-4-7-15(16)18-17(21)20-10-6-9-19(2)11-12-20/h4-5,7-8H,3,6,9-14H2,1-2H3
InChIKey
KBUZBQVCBVDWKX-UHFFFAOYSA-N
PubChem CID
3219

Spectroscopy

Tabs appear only for spectra stored with clear provenance.

Open library
No redistributable or simulated spectroscopy record is attached yet.

Simulated NMR

On-demand educational prediction for 1-(2-ethoxyethyl)-2-(4-methyl-1,4-diazepan-1-yl)benzimidazole; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for 1-(2-ethoxyethyl)-2-(4-methyl-1,4-diazepan-1-yl)benzimidazole; not experimental data.

Sources

Molecule identity

Retrieved 8/20/2026. Reuse status is summarized by the badge; open the source for full details.

Open source record