N-[(1S)-1-(1H-benzimidazol-2-yl)-2-phenyl-ethyl]-1-(4-fluorophenyl)carbonyl-piperidine-4-carboxamide

Systemtic Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-2-phenyl-ethyl]-1-(4-fluorophenyl)carbonyl-piperidine-4-carboxamide Openeye Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-2-phenyl-ethyl]-1-(4-fluorobenzoyl)piperidine-4-carboxamide CAS Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-2-phenylethyl]-1-[(4-fluorophenyl)-oxomethyl]-4-piperidinecarboxamide IUPAC Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-2-phenylethyl]-1-(4-fluorobenzoyl)piperidine-4-carboxamide Traditional Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-2-phenyl-ethyl]-1-(4-fluorobenzoyl)isonipecotamide Formula: C28H27FN4O2 MolecularWeight: 470.537983

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC(CC2=CC=CC=C2)C3=NC4=CC=CC=C4N3)C(=O)C5=CC=C(C=C5)F

Isomeric SMILES

C1CN(CCC1C(=O)N[C@@H](CC2=CC=CC=C2)C3=NC4=CC=CC=C4N3)C(=O)C5=CC=C(C=C5)F

InChI

InChI=1S/C28H27FN4O2/c29-22-12-10-21(11-13-22)28(35)33-16-14-20(15-17-33)27(34)32-25(18-19-6-2-1-3-7-19)26-30-23-8-4-5-9-24(23)31-26/h1-13,20,25H,14-18H2,(H,30,31)(H,32,34)/t25-/m0/s1