1-(azepan-1-yl)-2-(1,4-diphenylimidazol-2-yl)sulfanyl-ethanone

Systemtic Name: 1-(azepan-1-yl)-2-(1,4-diphenylimidazol-2-yl)sulfanyl-ethanone Openeye Name: 1-(azepan-1-yl)-2-(1,4-diphenylimidazol-2-yl)sulfanyl-ethanone CAS Name: 1-(1-azepanyl)-2-[(1,4-diphenyl-2-imidazolyl)thio]ethanone IUPAC Name: 1-(azepan-1-yl)-2-(1,4-diphenylimidazol-2-yl)sulfanylethanone Traditional Name: 1-(azepan-1-yl)-2-[(1,4-diphenylimidazol-2-yl)thio]ethanone Formula: C23H25N3OS MolecularWeight: 391.5291

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)CSC2=NC(=CN2C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1CCCN(CC1)C(=O)CSC2=NC(=CN2C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C23H25N3OS/c27-22(25-15-9-1-2-10-16-25)18-28-23-24-21(19-11-5-3-6-12-19)17-26(23)20-13-7-4-8-14-20/h3-8,11-14,17H,1-2,9-10,15-16,18H2