2-(4-bromanylphenoxy)-N-(4-cyano-2-quinolin-2-yl-pyrazol-3-yl)propanamide

Systemtic Name: 2-(4-bromanylphenoxy)-N-(4-cyano-2-quinolin-2-yl-pyrazol-3-yl)propanamide Openeye Name: 2-(4-bromophenoxy)-N-[4-cyano-2-(2-quinolyl)pyrazol-3-yl]propanamide CAS Name: 2-(4-bromophenoxy)-N-[4-cyano-2-(2-quinolinyl)-3-pyrazolyl]propanamide IUPAC Name: 2-(4-bromophenoxy)-N-(4-cyano-2-quinolin-2-ylpyrazol-3-yl)propanamide Traditional Name: 2-(4-bromophenoxy)-N-[4-cyano-2-(2-quinolyl)pyrazol-3-yl]propionamide Formula: C22H16BrN5O2 MolecularWeight: 462.29874

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=NN1C2=NC3=CC=CC=C3C=C2)C#N)OC4=CC=C(C=C4)Br

Isomeric SMILES

CC(C(=O)NC1=C(C=NN1C2=NC3=CC=CC=C3C=C2)C#N)OC4=CC=C(C=C4)Br

InChI

InChI=1S/C22H16BrN5O2/c1-14(30-18-9-7-17(23)8-10-18)22(29)27-21-16(12-24)13-25-28(21)20-11-6-15-4-2-3-5-19(15)26-20/h2-11,13-14H,1H3,(H,27,29)