2-pyridin-3-yl-N-(2-pyrrolidin-1-yl-2-thiophen-2-yl-ethyl)quinoline-4-carboxamide

Systemtic Name: 2-pyridin-3-yl-N-(2-pyrrolidin-1-yl-2-thiophen-2-yl-ethyl)quinoline-4-carboxamide Openeye Name: 2-(3-pyridyl)-N-[2-pyrrolidin-1-yl-2-(2-thienyl)ethyl]quinoline-4-carboxamide CAS Name: 2-(3-pyridinyl)-N-[2-(1-pyrrolidinyl)-2-thiophen-2-ylethyl]-4-quinolinecarboxamide IUPAC Name: 2-pyridin-3-yl-N-(2-pyrrolidin-1-yl-2-thiophen-2-ylethyl)quinoline-4-carboxamide Traditional Name: 2-(3-pyridyl)-N-[2-pyrrolidino-2-(2-thienyl)ethyl]cinchoninamide Formula: C25H24N4OS MolecularWeight: 428.54926

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(CNC(=O)C2=CC(=NC3=CC=CC=C32)C4=CN=CC=C4)C5=CC=CS5

Isomeric SMILES

C1CCN(C1)C(CNC(=O)C2=CC(=NC3=CC=CC=C32)C4=CN=CC=C4)C5=CC=CS5

InChI

InChI=1S/C25H24N4OS/c30-25(27-17-23(24-10-6-14-31-24)29-12-3-4-13-29)20-15-22(18-7-5-11-26-16-18)28-21-9-2-1-8-19(20)21/h1-2,5-11,14-16,23H,3-4,12-13,17H2,(H,27,30)