2-(4-fluorophenyl)sulfanyl-N-(3-pyrrolidin-1-ylpropyl)quinoline-4-carboxamide

Systemtic Name: 2-(4-fluorophenyl)sulfanyl-N-(3-pyrrolidin-1-ylpropyl)quinoline-4-carboxamide Openeye Name: 2-(4-fluorophenyl)sulfanyl-N-(3-pyrrolidin-1-ylpropyl)quinoline-4-carboxamide CAS Name: 2-[(4-fluorophenyl)thio]-N-[3-(1-pyrrolidinyl)propyl]-4-quinolinecarboxamide IUPAC Name: 2-(4-fluorophenyl)sulfanyl-N-(3-pyrrolidin-1-ylpropyl)quinoline-4-carboxamide Traditional Name: 2-[(4-fluorophenyl)thio]-N-(3-pyrrolidinopropyl)cinchoninamide Formula: C23H24FN3OS MolecularWeight: 409.519563

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCCNC(=O)C2=CC(=NC3=CC=CC=C32)SC4=CC=C(C=C4)F

Isomeric SMILES

C1CCN(C1)CCCNC(=O)C2=CC(=NC3=CC=CC=C32)SC4=CC=C(C=C4)F

InChI

InChI=1S/C23H24FN3OS/c24-17-8-10-18(11-9-17)29-22-16-20(19-6-1-2-7-21(19)26-22)23(28)25-12-5-15-27-13-3-4-14-27/h1-2,6-11,16H,3-5,12-15H2,(H,25,28)