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

Systemtic Name: 4-[8-(3-cyanophenyl)quinolin-2-yl]-N-thiophen-2-yl-piperazine-1-carboxamide Openeye Name: 4-[8-(3-cyanophenyl)-2-quinolyl]-N-(2-thienyl)piperazine-1-carboxamide CAS Name: 4-[8-(3-cyanophenyl)-2-quinolinyl]-N-thiophen-2-yl-1-piperazinecarboxamide IUPAC Name: 4-[8-(3-cyanophenyl)quinolin-2-yl]-N-thiophen-2-ylpiperazine-1-carboxamide Traditional Name: 4-[8-(3-cyanophenyl)-2-quinolyl]-N-(2-thienyl)piperazine-1-carboxamide Formula: C25H21N5OS MolecularWeight: 439.53214

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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=CS5

Isomeric SMILES

C1CN(CCN1C2=NC3=C(C=CC=C3C4=CC=CC(=C4)C#N)C=C2)C(=O)NC5=CC=CS5

InChI

InChI=1S/C25H21N5OS/c26-17-18-4-1-6-20(16-18)21-7-2-5-19-9-10-22(27-24(19)21)29-11-13-30(14-12-29)25(31)28-23-8-3-15-32-23/h1-10,15-16H,11-14H2,(H,28,31)