N-[1-[4-(azepan-1-yl)phenyl]ethylideneamino]-2-(4-fluorophenyl)quinoline-4-carboxamide

Systemtic Name: N-[1-[4-(azepan-1-yl)phenyl]ethylideneamino]-2-(4-fluorophenyl)quinoline-4-carboxamide Openeye Name: N-[1-[4-(azepan-1-yl)phenyl]ethylideneamino]-2-(4-fluorophenyl)quinoline-4-carboxamide CAS Name: N-[1-[4-(1-azepanyl)phenyl]ethylideneamino]-2-(4-fluorophenyl)-4-quinolinecarboxamide IUPAC Name: N-[1-[4-(azepan-1-yl)phenyl]ethylideneamino]-2-(4-fluorophenyl)quinoline-4-carboxamide Traditional Name: N-[1-[4-(azepan-1-yl)phenyl]ethylideneamino]-2-(4-fluorophenyl)cinchoninamide Formula: C30H29FN4O MolecularWeight: 480.575863

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC=C(C=C3)F)C4=CC=C(C=C4)N5CCCCCC5

Isomeric SMILES

CC(=NNC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC=C(C=C3)F)C4=CC=C(C=C4)N5CCCCCC5

InChI

InChI=1S/C30H29FN4O/c1-21(22-12-16-25(17-13-22)35-18-6-2-3-7-19-35)33-34-30(36)27-20-29(23-10-14-24(31)15-11-23)32-28-9-5-4-8-26(27)28/h4-5,8-17,20H,2-3,6-7,18-19H2,1H3,(H,34,36)