N-[3-(2-phenylethynyl)phenyl]-1-thiophen-2-ylcarbonyl-pyrrolidine-2-carboxamide

Systemtic Name: N-[3-(2-phenylethynyl)phenyl]-1-thiophen-2-ylcarbonyl-pyrrolidine-2-carboxamide Openeye Name: N-[3-(2-phenylethynyl)phenyl]-1-(thiophene-2-carbonyl)pyrrolidine-2-carboxamide CAS Name: 1-[oxo(thiophen-2-yl)methyl]-N-[3-(2-phenylethynyl)phenyl]-2-pyrrolidinecarboxamide IUPAC Name: N-[3-(2-phenylethynyl)phenyl]-1-(thiophene-2-carbonyl)pyrrolidine-2-carboxamide Traditional Name: N-[3-(2-phenylethynyl)phenyl]-1-(2-thenoyl)pyrrolidine-2-carboxamide Formula: C24H20N2O2S MolecularWeight: 400.4928

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C2=CC=CS2)C(=O)NC3=CC=CC(=C3)C#CC4=CC=CC=C4

Isomeric SMILES

C1CC(N(C1)C(=O)C2=CC=CS2)C(=O)NC3=CC=CC(=C3)C#CC4=CC=CC=C4

InChI

InChI=1S/C24H20N2O2S/c27-23(21-11-5-15-26(21)24(28)22-12-6-16-29-22)25-20-10-4-9-19(17-20)14-13-18-7-2-1-3-8-18/h1-4,6-10,12,16-17,21H,5,11,15H2,(H,25,27)