N-[(1S)-1-(1H-benzimidazol-2-yl)-2-phenyl-ethyl]-4-tert-butyl-cyclohexane-1-carboxamide

Systemtic Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-2-phenyl-ethyl]-4-tert-butyl-cyclohexane-1-carboxamide Openeye Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-2-phenyl-ethyl]-4-tert-butyl-cyclohexanecarboxamide CAS Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-2-phenylethyl]-4-tert-butyl-1-cyclohexanecarboxamide IUPAC Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-2-phenylethyl]-4-tert-butylcyclohexane-1-carboxamide Traditional Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-2-phenyl-ethyl]-4-tert-butyl-cyclohexanecarboxamide Formula: C26H33N3O MolecularWeight: 403.55972

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC(CC1)C(=O)NC(CC2=CC=CC=C2)C3=NC4=CC=CC=C4N3

Isomeric SMILES

CC(C)(C)C1CCC(CC1)C(=O)N[C@@H](CC2=CC=CC=C2)C3=NC4=CC=CC=C4N3

InChI

InChI=1S/C26H33N3O/c1-26(2,3)20-15-13-19(14-16-20)25(30)29-23(17-18-9-5-4-6-10-18)24-27-21-11-7-8-12-22(21)28-24/h4-12,19-20,23H,13-17H2,1-3H3,(H,27,28)(H,29,30)/t19?,20?,23-/m0/s1