3-(pyridin-2-ylmethylsulfanyl)-N-[3-(2-thiophen-2-ylethynyl)phenyl]propanamide

Systemtic Name: 3-(pyridin-2-ylmethylsulfanyl)-N-[3-(2-thiophen-2-ylethynyl)phenyl]propanamide Openeye Name: 3-(2-pyridylmethylsulfanyl)-N-[3-[2-(2-thienyl)ethynyl]phenyl]propanamide CAS Name: 3-(2-pyridinylmethylthio)-N-[3-(2-thiophen-2-ylethynyl)phenyl]propanamide IUPAC Name: 3-(pyridin-2-ylmethylsulfanyl)-N-[3-(2-thiophen-2-ylethynyl)phenyl]propanamide Traditional Name: 3-(2-pyridylmethylthio)-N-[3-[2-(2-thienyl)ethynyl]phenyl]propionamide Formula: C21H18N2OS2 MolecularWeight: 378.51042

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)CSCCC(=O)NC2=CC=CC(=C2)C#CC3=CC=CS3

Isomeric SMILES

C1=CC=NC(=C1)CSCCC(=O)NC2=CC=CC(=C2)C#CC3=CC=CS3

InChI

InChI=1S/C21H18N2OS2/c24-21(11-14-25-16-19-6-1-2-12-22-19)23-18-7-3-5-17(15-18)9-10-20-8-4-13-26-20/h1-8,12-13,15H,11,14,16H2,(H,23,24)