2-[5,7-bis(bromanyl)quinolin-8-yl]oxy-N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)ethanamide

Systemtic Name: 2-[5,7-bis(bromanyl)quinolin-8-yl]oxy-N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)ethanamide Openeye Name: 2-[(5,7-dibromo-8-quinolyl)oxy]-N-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)acetamide CAS Name: 2-[(5,7-dibromo-8-quinolinyl)oxy]-N-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)acetamide IUPAC Name: 2-(5,7-dibromoquinolin-8-yl)oxy-N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)acetamide Traditional Name: 2-[(5,7-dibromo-8-quinolyl)oxy]-N-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)acetamide Formula: C22H18Br2N4O3 MolecularWeight: 546.21132

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)COC3=C(C=C(C4=C3N=CC=C4)Br)Br

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)COC3=C(C=C(C4=C3N=CC=C4)Br)Br

InChI

InChI=1S/C22H18Br2N4O3/c1-13-19(22(30)28(27(13)2)14-7-4-3-5-8-14)26-18(29)12-31-21-17(24)11-16(23)15-9-6-10-25-20(15)21/h3-11H,12H2,1-2H3,(H,26,29)