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

Systemtic Name: 2-[[5-(2-bromophenyl)-1,3,4-oxadiazol-2-yl]methylsulfanyl]-N-cyclopropyl-quinoline-4-carboxamide Openeye Name: 2-[[5-(2-bromophenyl)-1,3,4-oxadiazol-2-yl]methylsulfanyl]-N-cyclopropyl-quinoline-4-carboxamide CAS Name: 2-[[5-(2-bromophenyl)-1,3,4-oxadiazol-2-yl]methylthio]-N-cyclopropyl-4-quinolinecarboxamide IUPAC Name: 2-[[5-(2-bromophenyl)-1,3,4-oxadiazol-2-yl]methylsulfanyl]-N-cyclopropylquinoline-4-carboxamide Traditional Name: 2-[[5-(2-bromophenyl)-1,3,4-oxadiazol-2-yl]methylthio]-N-cyclopropyl-cinchoninamide Formula: C22H17BrN4O2S MolecularWeight: 481.36498

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C2=CC(=NC3=CC=CC=C32)SCC4=NN=C(O4)C5=CC=CC=C5Br

Isomeric SMILES

C1CC1NC(=O)C2=CC(=NC3=CC=CC=C32)SCC4=NN=C(O4)C5=CC=CC=C5Br

InChI

InChI=1S/C22H17BrN4O2S/c23-17-7-3-1-6-15(17)22-27-26-19(29-22)12-30-20-11-16(21(28)24-13-9-10-13)14-5-2-4-8-18(14)25-20/h1-8,11,13H,9-10,12H2,(H,24,28)