N-(3-ethynylphenyl)-2-thiophen-3-yl-pyrrolidine-1-carboxamide

Systemtic Name: N-(3-ethynylphenyl)-2-thiophen-3-yl-pyrrolidine-1-carboxamide Openeye Name: N-(3-ethynylphenyl)-2-(3-thienyl)pyrrolidine-1-carboxamide CAS Name: N-(3-ethynylphenyl)-2-(3-thiophenyl)-1-pyrrolidinecarboxamide IUPAC Name: N-(3-ethynylphenyl)-2-thiophen-3-ylpyrrolidine-1-carboxamide Traditional Name: N-(3-ethynylphenyl)-2-(3-thienyl)pyrrolidine-1-carboxamide Formula: C17H16N2OS MolecularWeight: 296.38674

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CC(=CC=C1)NC(=O)N2CCCC2C3=CSC=C3

Isomeric SMILES

C#CC1=CC(=CC=C1)NC(=O)N2CCCC2C3=CSC=C3

InChI

InChI=1S/C17H16N2OS/c1-2-13-5-3-6-15(11-13)18-17(20)19-9-4-7-16(19)14-8-10-21-12-14/h1,3,5-6,8,10-12,16H,4,7,9H2,(H,18,20)