4-[(4-cyanophenyl)methyl]-N-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]piperazine-1-carboxamide

Systemtic Name: 4-[(4-cyanophenyl)methyl]-N-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]piperazine-1-carboxamide Openeye Name: 4-[(4-cyanophenyl)methyl]-N-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]piperazine-1-carboxamide CAS Name: 4-[(4-cyanophenyl)methyl]-N-[[2-(1-pyrrolidinylmethyl)phenyl]methyl]-1-piperazinecarboxamide IUPAC Name: 4-[(4-cyanophenyl)methyl]-N-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]piperazine-1-carboxamide Traditional Name: 4-(4-cyanobenzyl)-N-[2-(pyrrolidinomethyl)benzyl]piperazine-1-carboxamide Formula: C25H31N5O MolecularWeight: 417.54654

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC2=CC=CC=C2CNC(=O)N3CCN(CC3)CC4=CC=C(C=C4)C#N

Isomeric SMILES

C1CCN(C1)CC2=CC=CC=C2CNC(=O)N3CCN(CC3)CC4=CC=C(C=C4)C#N

InChI

InChI=1S/C25H31N5O/c26-17-21-7-9-22(10-8-21)19-29-13-15-30(16-14-29)25(31)27-18-23-5-1-2-6-24(23)20-28-11-3-4-12-28/h1-2,5-10H,3-4,11-16,18-20H2,(H,27,31)