N-[4-[4-(phenylmethyl)piperazin-1-yl]phenyl]-2-pyrrolidin-1-yl-pyridine-3-carboxamide

Systemtic Name: N-[4-[4-(phenylmethyl)piperazin-1-yl]phenyl]-2-pyrrolidin-1-yl-pyridine-3-carboxamide Openeye Name: N-[4-(4-benzylpiperazin-1-yl)phenyl]-2-pyrrolidin-1-yl-pyridine-3-carboxamide CAS Name: N-[4-[4-(phenylmethyl)-1-piperazinyl]phenyl]-2-(1-pyrrolidinyl)-3-pyridinecarboxamide IUPAC Name: N-[4-(4-benzylpiperazin-1-yl)phenyl]-2-pyrrolidin-1-ylpyridine-3-carboxamide Traditional Name: N-[4-(4-benzylpiperazino)phenyl]-2-pyrrolidino-nicotinamide Formula: C27H31N5O MolecularWeight: 441.56794

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=CC=N2)C(=O)NC3=CC=C(C=C3)N4CCN(CC4)CC5=CC=CC=C5

Isomeric SMILES

C1CCN(C1)C2=C(C=CC=N2)C(=O)NC3=CC=C(C=C3)N4CCN(CC4)CC5=CC=CC=C5

InChI

InChI=1S/C27H31N5O/c33-27(25-9-6-14-28-26(25)32-15-4-5-16-32)29-23-10-12-24(13-11-23)31-19-17-30(18-20-31)21-22-7-2-1-3-8-22/h1-3,6-14H,4-5,15-21H2,(H,29,33)