1-(2-cyanophenyl)sulfonyl-N-[3-(2-thiophen-2-ylethynyl)phenyl]piperidine-4-carboxamide

Systemtic Name: 1-(2-cyanophenyl)sulfonyl-N-[3-(2-thiophen-2-ylethynyl)phenyl]piperidine-4-carboxamide Openeye Name: 1-(2-cyanophenyl)sulfonyl-N-[3-[2-(2-thienyl)ethynyl]phenyl]piperidine-4-carboxamide CAS Name: 1-(2-cyanophenyl)sulfonyl-N-[3-(2-thiophen-2-ylethynyl)phenyl]-4-piperidinecarboxamide IUPAC Name: 1-(2-cyanophenyl)sulfonyl-N-[3-(2-thiophen-2-ylethynyl)phenyl]piperidine-4-carboxamide Traditional Name: 1-(2-cyanophenyl)sulfonyl-N-[3-[2-(2-thienyl)ethynyl]phenyl]isonipecotamide Formula: C25H21N3O3S2 MolecularWeight: 475.58254

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC=CC(=C2)C#CC3=CC=CS3)S(=O)(=O)C4=CC=CC=C4C#N

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC=CC(=C2)C#CC3=CC=CS3)S(=O)(=O)C4=CC=CC=C4C#N

InChI

InChI=1S/C25H21N3O3S2/c26-18-21-6-1-2-9-24(21)33(30,31)28-14-12-20(13-15-28)25(29)27-22-7-3-5-19(17-22)10-11-23-8-4-16-32-23/h1-9,16-17,20H,12-15H2,(H,27,29)