N-[4-cyano-2-(8-methoxy-4-methyl-quinolin-2-yl)pyrazol-3-yl]-2-iodanyl-benzamide

Systemtic Name: N-[4-cyano-2-(8-methoxy-4-methyl-quinolin-2-yl)pyrazol-3-yl]-2-iodanyl-benzamide Openeye Name: N-[4-cyano-2-(8-methoxy-4-methyl-2-quinolyl)pyrazol-3-yl]-2-iodo-benzamide CAS Name: N-[4-cyano-2-(8-methoxy-4-methyl-2-quinolinyl)-3-pyrazolyl]-2-iodobenzamide IUPAC Name: N-[4-cyano-2-(8-methoxy-4-methylquinolin-2-yl)pyrazol-3-yl]-2-iodobenzamide Traditional Name: N-[4-cyano-2-(8-methoxy-4-methyl-2-quinolyl)pyrazol-3-yl]-2-iodo-benzamide Formula: C22H16IN5O2 MolecularWeight: 509.29921

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C1C=CC=C2OC)N3C(=C(C=N3)C#N)NC(=O)C4=CC=CC=C4I

Isomeric SMILES

CC1=CC(=NC2=C1C=CC=C2OC)N3C(=C(C=N3)C#N)NC(=O)C4=CC=CC=C4I

InChI

InChI=1S/C22H16IN5O2/c1-13-10-19(26-20-15(13)7-5-9-18(20)30-2)28-21(14(11-24)12-25-28)27-22(29)16-6-3-4-8-17(16)23/h3-10,12H,1-2H3,(H,27,29)