N-cyclopropyl-2-[[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]quinoline-4-carboxamide

Systemtic Name: N-cyclopropyl-2-[[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]quinoline-4-carboxamide Openeye Name: N-cyclopropyl-2-[[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]quinoline-4-carboxamide CAS Name: N-cyclopropyl-2-[[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]methylthio]-4-quinolinecarboxamide IUPAC Name: N-cyclopropyl-2-[[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]quinoline-4-carboxamide Traditional Name: N-cyclopropyl-2-[[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]methylthio]cinchoninamide Formula: C22H17FN4O2S MolecularWeight: 420.459383

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C2=CC(=NC3=CC=CC=C32)SCC4=NC(=NO4)C5=CC=C(C=C5)F

Isomeric SMILES

C1CC1NC(=O)C2=CC(=NC3=CC=CC=C32)SCC4=NC(=NO4)C5=CC=C(C=C5)F

InChI

InChI=1S/C22H17FN4O2S/c23-14-7-5-13(6-8-14)21-26-19(29-27-21)12-30-20-11-17(22(28)24-15-9-10-15)16-3-1-2-4-18(16)25-20/h1-8,11,15H,9-10,12H2,(H,24,28)