1-(N-cyano-N'-propan-2-yl-carbamimidoyl)-N-[(4-fluorophenyl)methyl]-4-phenyl-piperidine-4-carboxamide

Systemtic Name: 1-(N-cyano-N'-propan-2-yl-carbamimidoyl)-N-[(4-fluorophenyl)methyl]-4-phenyl-piperidine-4-carboxamide Openeye Name: 1-(N-cyano-N'-isopropyl-carbamimidoyl)-N-[(4-fluorophenyl)methyl]-4-phenyl-piperidine-4-carboxamide CAS Name: 1-[(cyanoamino)-propan-2-yliminomethyl]-N-[(4-fluorophenyl)methyl]-4-phenyl-4-piperidinecarboxamide IUPAC Name: 1-(N-cyano-N'-propan-2-ylcarbamimidoyl)-N-[(4-fluorophenyl)methyl]-4-phenylpiperidine-4-carboxamide Traditional Name: 1-(N-cyano-N'-isopropyl-amidino)-N-(4-fluorobenzyl)-4-phenyl-isonipecotamide Formula: C24H28FN5O MolecularWeight: 421.510423

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H28FN5O/c1-18(2)29-23(28-17-26)30-14-12-24(13-15-30,20-6-4-3-5-7-20)22(31)27-16-19-8-10-21(25)11-9-19/h3-11,18H,12-16H2,1-2H3,(H,27,31)(H,28,29)