N-[[1-(N-cyano-N'-ethyl-carbamimidoyl)-4-phenyl-piperidin-4-yl]methyl]-3-fluoranyl-benzamide

Systemtic Name: N-[[1-(N-cyano-N'-ethyl-carbamimidoyl)-4-phenyl-piperidin-4-yl]methyl]-3-fluoranyl-benzamide Openeye Name: N-[[1-(N-cyano-N'-ethyl-carbamimidoyl)-4-phenyl-4-piperidyl]methyl]-3-fluoro-benzamide CAS Name: N-[[1-[(cyanoamino)-ethyliminomethyl]-4-phenyl-4-piperidinyl]methyl]-3-fluorobenzamide IUPAC Name: N-[[1-(N-cyano-N'-ethylcarbamimidoyl)-4-phenylpiperidin-4-yl]methyl]-3-fluorobenzamide Traditional Name: N-[[1-(N-cyano-N'-ethyl-amidino)-4-phenyl-4-piperidyl]methyl]-3-fluoro-benzamide Formula: C23H26FN5O MolecularWeight: 407.483843

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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