1-(3-methoxyphenyl)-5-oxidanylidene-N-[3-(2-pyridin-2-ylethynyl)phenyl]pyrrolidine-3-carboxamide

Systemtic Name: 1-(3-methoxyphenyl)-5-oxidanylidene-N-[3-(2-pyridin-2-ylethynyl)phenyl]pyrrolidine-3-carboxamide Openeye Name: 1-(3-methoxyphenyl)-5-oxo-N-[3-[2-(2-pyridyl)ethynyl]phenyl]pyrrolidine-3-carboxamide CAS Name: 1-(3-methoxyphenyl)-5-oxo-N-[3-[2-(2-pyridinyl)ethynyl]phenyl]-3-pyrrolidinecarboxamide IUPAC Name: 1-(3-methoxyphenyl)-5-oxo-N-[3-(2-pyridin-2-ylethynyl)phenyl]pyrrolidine-3-carboxamide Traditional Name: 5-keto-1-(3-methoxyphenyl)-N-[3-[2-(2-pyridyl)ethynyl]phenyl]pyrrolidine-3-carboxamide Formula: C25H21N3O3 MolecularWeight: 411.45254

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2CC(CC2=O)C(=O)NC3=CC=CC(=C3)C#CC4=CC=CC=N4

Isomeric SMILES

COC1=CC=CC(=C1)N2CC(CC2=O)C(=O)NC3=CC=CC(=C3)C#CC4=CC=CC=N4

InChI

InChI=1S/C25H21N3O3/c1-31-23-10-5-9-22(16-23)28-17-19(15-24(28)29)25(30)27-21-8-4-6-18(14-21)11-12-20-7-2-3-13-26-20/h2-10,13-14,16,19H,15,17H2,1H3,(H,27,30)