4-[8-(3-cyanophenyl)quinolin-2-yl]-N-(3-fluorophenyl)piperazine-1-carboxamide

Systemtic Name: 4-[8-(3-cyanophenyl)quinolin-2-yl]-N-(3-fluorophenyl)piperazine-1-carboxamide Openeye Name: 4-[8-(3-cyanophenyl)-2-quinolyl]-N-(3-fluorophenyl)piperazine-1-carboxamide CAS Name: 4-[8-(3-cyanophenyl)-2-quinolinyl]-N-(3-fluorophenyl)-1-piperazinecarboxamide IUPAC Name: 4-[8-(3-cyanophenyl)quinolin-2-yl]-N-(3-fluorophenyl)piperazine-1-carboxamide Traditional Name: 4-[8-(3-cyanophenyl)-2-quinolyl]-N-(3-fluorophenyl)piperazine-1-carboxamide Formula: C27H22FN5O MolecularWeight: 451.494883

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC3=C(C=CC=C3C4=CC=CC(=C4)C#N)C=C2)C(=O)NC5=CC(=CC=C5)F

Isomeric SMILES

C1CN(CCN1C2=NC3=C(C=CC=C3C4=CC=CC(=C4)C#N)C=C2)C(=O)NC5=CC(=CC=C5)F

InChI

InChI=1S/C27H22FN5O/c28-22-7-3-8-23(17-22)30-27(34)33-14-12-32(13-15-33)25-11-10-20-5-2-9-24(26(20)31-25)21-6-1-4-19(16-21)18-29/h1-11,16-17H,12-15H2,(H,30,34)