2-propylsulfonyl-N-[3-(2-pyridin-2-ylethynyl)phenyl]benzamide

Systemtic Name: 2-propylsulfonyl-N-[3-(2-pyridin-2-ylethynyl)phenyl]benzamide Openeye Name: 2-propylsulfonyl-N-[3-[2-(2-pyridyl)ethynyl]phenyl]benzamide CAS Name: 2-propylsulfonyl-N-[3-[2-(2-pyridinyl)ethynyl]phenyl]benzamide IUPAC Name: 2-propylsulfonyl-N-[3-(2-pyridin-2-ylethynyl)phenyl]benzamide Traditional Name: 2-propylsulfonyl-N-[3-[2-(2-pyridyl)ethynyl]phenyl]benzamide Formula: C23H20N2O3S MolecularWeight: 404.4815

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)C1=CC=CC=C1C(=O)NC2=CC=CC(=C2)C#CC3=CC=CC=N3

Isomeric SMILES

CCCS(=O)(=O)C1=CC=CC=C1C(=O)NC2=CC=CC(=C2)C#CC3=CC=CC=N3

InChI

InChI=1S/C23H20N2O3S/c1-2-16-29(27,28)22-12-4-3-11-21(22)23(26)25-20-10-7-8-18(17-20)13-14-19-9-5-6-15-24-19/h3-12,15,17H,2,16H2,1H3,(H,25,26)