1-(1-adamantyl)-2-[1-(phenylmethyl)benzimidazol-2-yl]sulfanyl-ethanone

Systemtic Name: 1-(1-adamantyl)-2-[1-(phenylmethyl)benzimidazol-2-yl]sulfanyl-ethanone Openeye Name: 1-(1-adamantyl)-2-(1-benzylbenzimidazol-2-yl)sulfanyl-ethanone CAS Name: 1-(1-adamantyl)-2-[[1-(phenylmethyl)-2-benzimidazolyl]thio]ethanone IUPAC Name: 1-(1-adamantyl)-2-(1-benzylbenzimidazol-2-yl)sulfanylethanone Traditional Name: 1-(1-adamantyl)-2-[(1-benzylbenzimidazol-2-yl)thio]ethanone Formula: C26H28N2OS MolecularWeight: 416.57832

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)CSC4=NC5=CC=CC=C5N4CC6=CC=CC=C6

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)CSC4=NC5=CC=CC=C5N4CC6=CC=CC=C6

InChI

InChI=1S/C26H28N2OS/c29-24(26-13-19-10-20(14-26)12-21(11-19)15-26)17-30-25-27-22-8-4-5-9-23(22)28(25)16-18-6-2-1-3-7-18/h1-9,19-21H,10-17H2