N-(4-cyano-2-quinolin-2-yl-pyrazol-3-yl)-2-iodanyl-benzamide

Systemtic Name: N-(4-cyano-2-quinolin-2-yl-pyrazol-3-yl)-2-iodanyl-benzamide Openeye Name: N-[4-cyano-2-(2-quinolyl)pyrazol-3-yl]-2-iodo-benzamide CAS Name: N-[4-cyano-2-(2-quinolinyl)-3-pyrazolyl]-2-iodobenzamide IUPAC Name: N-(4-cyano-2-quinolin-2-ylpyrazol-3-yl)-2-iodobenzamide Traditional Name: N-[4-cyano-2-(2-quinolyl)pyrazol-3-yl]-2-iodo-benzamide Formula: C20H12IN5O MolecularWeight: 465.24665

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=N2)N3C(=C(C=N3)C#N)NC(=O)C4=CC=CC=C4I

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=N2)N3C(=C(C=N3)C#N)NC(=O)C4=CC=CC=C4I

InChI

InChI=1S/C20H12IN5O/c21-16-7-3-2-6-15(16)20(27)25-19-14(11-22)12-23-26(19)18-10-9-13-5-1-4-8-17(13)24-18/h1-10,12H,(H,25,27)