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

Systemtic Name: 1-cyclopropylcarbonyl-N-[3-(2-thiophen-2-ylethynyl)phenyl]piperidine-4-carboxamide Openeye Name: 1-(cyclopropanecarbonyl)-N-[3-[2-(2-thienyl)ethynyl]phenyl]piperidine-4-carboxamide CAS Name: 1-[cyclopropyl(oxo)methyl]-N-[3-(2-thiophen-2-ylethynyl)phenyl]-4-piperidinecarboxamide IUPAC Name: 1-(cyclopropanecarbonyl)-N-[3-(2-thiophen-2-ylethynyl)phenyl]piperidine-4-carboxamide Traditional Name: 1-(cyclopropanecarbonyl)-N-[3-[2-(2-thienyl)ethynyl]phenyl]isonipecotamide Formula: C22H22N2O2S MolecularWeight: 378.48728

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)N2CCC(CC2)C(=O)NC3=CC=CC(=C3)C#CC4=CC=CS4

Isomeric SMILES

C1CC1C(=O)N2CCC(CC2)C(=O)NC3=CC=CC(=C3)C#CC4=CC=CS4

InChI

InChI=1S/C22H22N2O2S/c25-21(17-10-12-24(13-11-17)22(26)18-7-8-18)23-19-4-1-3-16(15-19)6-9-20-5-2-14-27-20/h1-5,14-15,17-18H,7-8,10-13H2,(H,23,25)