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

Systemtic Name: 2-pyridin-3-yl-N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]quinoline-4-carboxamide Openeye Name: 2-(3-pyridyl)-N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]quinoline-4-carboxamide CAS Name: 2-(3-pyridinyl)-N-[[4-(1-pyrrolidinylmethyl)phenyl]methyl]-4-quinolinecarboxamide IUPAC Name: 2-pyridin-3-yl-N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]quinoline-4-carboxamide Traditional Name: 2-(3-pyridyl)-N-[4-(pyrrolidinomethyl)benzyl]cinchoninamide Formula: C27H26N4O MolecularWeight: 422.52154

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC2=CC=C(C=C2)CNC(=O)C3=CC(=NC4=CC=CC=C43)C5=CN=CC=C5

Isomeric SMILES

C1CCN(C1)CC2=CC=C(C=C2)CNC(=O)C3=CC(=NC4=CC=CC=C43)C5=CN=CC=C5

InChI

InChI=1S/C27H26N4O/c32-27(29-17-20-9-11-21(12-10-20)19-31-14-3-4-15-31)24-16-26(22-6-5-13-28-18-22)30-25-8-2-1-7-23(24)25/h1-2,5-13,16,18H,3-4,14-15,17,19H2,(H,29,32)