1-(1-adamantyl)-2-[2-azanylidene-3-(phenylmethyl)benzimidazol-1-yl]ethanone

Systemtic Name: 1-(1-adamantyl)-2-[2-azanylidene-3-(phenylmethyl)benzimidazol-1-yl]ethanone Openeye Name: 1-(1-adamantyl)-2-(3-benzyl-2-imino-benzimidazol-1-yl)ethanone CAS Name: 1-(1-adamantyl)-2-[2-imino-3-(phenylmethyl)-1-benzimidazolyl]ethanone IUPAC Name: 1-(1-adamantyl)-2-(3-benzyl-2-iminobenzimidazol-1-yl)ethanone Traditional Name: 1-(1-adamantyl)-2-(3-benzyl-2-imino-benzimidazol-1-yl)ethanone Formula: C26H29N3O MolecularWeight: 399.52796

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)CN4C5=CC=CC=C5N(C4=N)CC6=CC=CC=C6

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)CN4C5=CC=CC=C5N(C4=N)CC6=CC=CC=C6

InChI

InChI=1S/C26H29N3O/c27-25-28(16-18-6-2-1-3-7-18)22-8-4-5-9-23(22)29(25)17-24(30)26-13-19-10-20(14-26)12-21(11-19)15-26/h1-9,19-21,27H,10-17H2