4-tert-butyl-N-[3-(2-pyridin-2-ylethynyl)phenyl]benzamide

Systemtic Name: 4-tert-butyl-N-[3-(2-pyridin-2-ylethynyl)phenyl]benzamide Openeye Name: 4-tert-butyl-N-[3-[2-(2-pyridyl)ethynyl]phenyl]benzamide CAS Name: 4-tert-butyl-N-[3-[2-(2-pyridinyl)ethynyl]phenyl]benzamide IUPAC Name: 4-tert-butyl-N-[3-(2-pyridin-2-ylethynyl)phenyl]benzamide Traditional Name: 4-tert-butyl-N-[3-[2-(2-pyridyl)ethynyl]phenyl]benzamide Formula: C24H22N2O MolecularWeight: 354.44428

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H22N2O/c1-24(2,3)20-13-11-19(12-14-20)23(27)26-22-9-6-7-18(17-22)10-15-21-8-4-5-16-25-21/h4-9,11-14,16-17H,1-3H3,(H,26,27)