1-phenyl-3-pyridin-3-yl-N-[3-(2-pyridin-2-ylethynyl)phenyl]pyrazole-4-carboxamide

Systemtic Name: 1-phenyl-3-pyridin-3-yl-N-[3-(2-pyridin-2-ylethynyl)phenyl]pyrazole-4-carboxamide Openeye Name: 1-phenyl-3-(3-pyridyl)-N-[3-[2-(2-pyridyl)ethynyl]phenyl]pyrazole-4-carboxamide CAS Name: 1-phenyl-3-(3-pyridinyl)-N-[3-[2-(2-pyridinyl)ethynyl]phenyl]-4-pyrazolecarboxamide IUPAC Name: 1-phenyl-3-pyridin-3-yl-N-[3-(2-pyridin-2-ylethynyl)phenyl]pyrazole-4-carboxamide Traditional Name: 1-phenyl-3-(3-pyridyl)-N-[3-[2-(2-pyridyl)ethynyl]phenyl]pyrazole-4-carboxamide Formula: C28H19N5O MolecularWeight: 441.48336

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CN=CC=C3)C(=O)NC4=CC=CC(=C4)C#CC5=CC=CC=N5

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CN=CC=C3)C(=O)NC4=CC=CC(=C4)C#CC5=CC=CC=N5

InChI

InChI=1S/C28H19N5O/c34-28(31-24-11-6-8-21(18-24)14-15-23-10-4-5-17-30-23)26-20-33(25-12-2-1-3-13-25)32-27(26)22-9-7-16-29-19-22/h1-13,16-20H,(H,31,34)