N-(2-cyanophenyl)-4-(8-thiophen-2-ylquinolin-2-yl)piperazine-1-carboxamide

Systemtic Name: N-(2-cyanophenyl)-4-(8-thiophen-2-ylquinolin-2-yl)piperazine-1-carboxamide Openeye Name: N-(2-cyanophenyl)-4-[8-(2-thienyl)-2-quinolyl]piperazine-1-carboxamide CAS Name: N-(2-cyanophenyl)-4-(8-thiophen-2-yl-2-quinolinyl)-1-piperazinecarboxamide IUPAC Name: N-(2-cyanophenyl)-4-(8-thiophen-2-ylquinolin-2-yl)piperazine-1-carboxamide Traditional Name: N-(2-cyanophenyl)-4-[8-(2-thienyl)-2-quinolyl]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=CS4)C=C2)C(=O)NC5=CC=CC=C5C#N

Isomeric SMILES

C1CN(CCN1C2=NC3=C(C=CC=C3C4=CC=CS4)C=C2)C(=O)NC5=CC=CC=C5C#N

InChI

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