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

Systemtic Name: N-[3-(2-pyridin-2-ylethynyl)phenyl]-3-(pyrimidin-2-ylamino)benzamide Openeye Name: N-[3-[2-(2-pyridyl)ethynyl]phenyl]-3-(pyrimidin-2-ylamino)benzamide CAS Name: N-[3-[2-(2-pyridinyl)ethynyl]phenyl]-3-(2-pyrimidinylamino)benzamide IUPAC Name: N-[3-(2-pyridin-2-ylethynyl)phenyl]-3-(pyrimidin-2-ylamino)benzamide Traditional Name: N-[3-[2-(2-pyridyl)ethynyl]phenyl]-3-(2-pyrimidylamino)benzamide Formula: C24H17N5O MolecularWeight: 391.42468

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)C#CC2=CC(=CC=C2)NC(=O)C3=CC(=CC=C3)NC4=NC=CC=N4

Isomeric SMILES

C1=CC=NC(=C1)C#CC2=CC(=CC=C2)NC(=O)C3=CC(=CC=C3)NC4=NC=CC=N4

InChI

InChI=1S/C24H17N5O/c30-23(19-7-4-10-22(17-19)29-24-26-14-5-15-27-24)28-21-9-3-6-18(16-21)11-12-20-8-1-2-13-25-20/h1-10,13-17H,(H,28,30)(H,26,27,29)