N-(cyanomethyl)-1-[4-(3-piperazin-1-ylphenyl)phenyl]piperidine-2-carboxamide

Systemtic Name: N-(cyanomethyl)-1-[4-(3-piperazin-1-ylphenyl)phenyl]piperidine-2-carboxamide Openeye Name: N-(cyanomethyl)-1-[4-(3-piperazin-1-ylphenyl)phenyl]piperidine-2-carboxamide CAS Name: N-(cyanomethyl)-1-[4-[3-(1-piperazinyl)phenyl]phenyl]-2-piperidinecarboxamide IUPAC Name: N-(cyanomethyl)-1-[4-(3-piperazin-1-ylphenyl)phenyl]piperidine-2-carboxamide Traditional Name: N-(cyanomethyl)-1-[4-(3-piperazinophenyl)phenyl]pipecolinamide Formula: C24H29N5O MolecularWeight: 403.51996

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)NCC#N)C2=CC=C(C=C2)C3=CC(=CC=C3)N4CCNCC4

Isomeric SMILES

C1CCN(C(C1)C(=O)NCC#N)C2=CC=C(C=C2)C3=CC(=CC=C3)N4CCNCC4

InChI

InChI=1S/C24H29N5O/c25-11-12-27-24(30)23-6-1-2-15-29(23)21-9-7-19(8-10-21)20-4-3-5-22(18-20)28-16-13-26-14-17-28/h3-5,7-10,18,23,26H,1-2,6,12-17H2,(H,27,30)