2-[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]-N-cyclopropyl-quinoline-4-carboxamide

Systemtic Name: 2-[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]-N-cyclopropyl-quinoline-4-carboxamide Openeye Name: 2-[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]-N-cyclopropyl-quinoline-4-carboxamide CAS Name: 2-[4-[bis(4-fluorophenyl)methyl]-1-piperazinyl]-N-cyclopropyl-4-quinolinecarboxamide IUPAC Name: 2-[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]-N-cyclopropylquinoline-4-carboxamide Traditional Name: 2-[4-[bis(4-fluorophenyl)methyl]piperazino]-N-cyclopropyl-cinchoninamide Formula: C30H28F2N4O MolecularWeight: 498.566326

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C2=CC(=NC3=CC=CC=C32)N4CCN(CC4)C(C5=CC=C(C=C5)F)C6=CC=C(C=C6)F

Isomeric SMILES

C1CC1NC(=O)C2=CC(=NC3=CC=CC=C32)N4CCN(CC4)C(C5=CC=C(C=C5)F)C6=CC=C(C=C6)F

InChI

InChI=1S/C30H28F2N4O/c31-22-9-5-20(6-10-22)29(21-7-11-23(32)12-8-21)36-17-15-35(16-18-36)28-19-26(30(37)33-24-13-14-24)25-3-1-2-4-27(25)34-28/h1-12,19,24,29H,13-18H2,(H,33,37)