1-pyrazin-2-yl-N-[[2-[4-(pyrrolidin-1-ylmethyl)phenyl]phenyl]methyl]piperidine-3-carboxamide

Systemtic Name: 1-pyrazin-2-yl-N-[[2-[4-(pyrrolidin-1-ylmethyl)phenyl]phenyl]methyl]piperidine-3-carboxamide Openeye Name: 1-pyrazin-2-yl-N-[[2-[4-(pyrrolidin-1-ylmethyl)phenyl]phenyl]methyl]piperidine-3-carboxamide CAS Name: 1-(2-pyrazinyl)-N-[[2-[4-(1-pyrrolidinylmethyl)phenyl]phenyl]methyl]-3-piperidinecarboxamide IUPAC Name: 1-pyrazin-2-yl-N-[[2-[4-(pyrrolidin-1-ylmethyl)phenyl]phenyl]methyl]piperidine-3-carboxamide Traditional Name: 1-pyrazin-2-yl-N-[2-[4-(pyrrolidinomethyl)phenyl]benzyl]nipecotamide Formula: C28H33N5O MolecularWeight: 455.59452

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC2=CC=C(C=C2)C3=CC=CC=C3CNC(=O)C4CCCN(C4)C5=NC=CN=C5

Isomeric SMILES

C1CCN(C1)CC2=CC=C(C=C2)C3=CC=CC=C3CNC(=O)C4CCCN(C4)C5=NC=CN=C5

InChI

InChI=1S/C28H33N5O/c34-28(25-7-5-17-33(21-25)27-19-29-13-14-30-27)31-18-24-6-1-2-8-26(24)23-11-9-22(10-12-23)20-32-15-3-4-16-32/h1-2,6,8-14,19,25H,3-5,7,15-18,20-21H2,(H,31,34)