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

Systemtic Name: N-(2-cyanophenyl)-4-[8-(4-fluorophenyl)quinolin-2-yl]piperazine-1-carboxamide Openeye Name: N-(2-cyanophenyl)-4-[8-(4-fluorophenyl)-2-quinolyl]piperazine-1-carboxamide CAS Name: N-(2-cyanophenyl)-4-[8-(4-fluorophenyl)-2-quinolinyl]-1-piperazinecarboxamide IUPAC Name: N-(2-cyanophenyl)-4-[8-(4-fluorophenyl)quinolin-2-yl]piperazine-1-carboxamide Traditional Name: N-(2-cyanophenyl)-4-[8-(4-fluorophenyl)-2-quinolyl]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=C(C=C4)F)C=C2)C(=O)NC5=CC=CC=C5C#N

Isomeric SMILES

C1CN(CCN1C2=NC3=C(C=CC=C3C4=CC=C(C=C4)F)C=C2)C(=O)NC5=CC=CC=C5C#N

InChI

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