1-(N-cyano-N'-ethyl-carbamimidoyl)-N-[(4-fluorophenyl)methyl]-4-phenyl-piperidine-4-carboxamide

Systemtic Name: 1-(N-cyano-N'-ethyl-carbamimidoyl)-N-[(4-fluorophenyl)methyl]-4-phenyl-piperidine-4-carboxamide Openeye Name: 1-(N-cyano-N'-ethyl-carbamimidoyl)-N-[(4-fluorophenyl)methyl]-4-phenyl-piperidine-4-carboxamide CAS Name: 1-[(cyanoamino)-ethyliminomethyl]-N-[(4-fluorophenyl)methyl]-4-phenyl-4-piperidinecarboxamide IUPAC Name: 1-(N-cyano-N'-ethylcarbamimidoyl)-N-[(4-fluorophenyl)methyl]-4-phenylpiperidine-4-carboxamide Traditional Name: 1-(N-cyano-N'-ethyl-amidino)-N-(4-fluorobenzyl)-4-phenyl-isonipecotamide Formula: C23H26FN5O MolecularWeight: 407.483843

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN=C(NC#N)N1CCC(CC1)(C2=CC=CC=C2)C(=O)NCC3=CC=C(C=C3)F

Isomeric SMILES

CCN=C(NC#N)N1CCC(CC1)(C2=CC=CC=C2)C(=O)NCC3=CC=C(C=C3)F

InChI

InChI=1S/C23H26FN5O/c1-2-26-22(28-17-25)29-14-12-23(13-15-29,19-6-4-3-5-7-19)21(30)27-16-18-8-10-20(24)11-9-18/h3-11H,2,12-16H2,1H3,(H,26,28)(H,27,30)